mango thiol
2,3 or 10-mercaptopinane
 
Notes:
Used as a food additive [EAFUS]
  • BOC Sciences
    • BOC Sciences
      Best of Chemicals Supplier
      Quality supplier of research chemicals and biochemicals including inhibitors, building blocks, GMP Products, impurities and metabolites, APIs for Veterinary, Natural Compounds, ADCs, Stem Cell Molecule and chiral compounds.
      BOC Sciences provides a wide range of services to support the pharmaceutical industry through all stages of drug discovery including Custom Synthesis of those chemicals that are not in stock, Isotope Labeling Service, Chiral Synthesis and Resolution, Bioconjugation, PEGylation services, analytical services.
      BOC Sciences is a brand of BOCSCI Inc. We leverage our wide spectrum of business in the fields of development, manufacturing, marketing, and distribution to help you make best-informed decisions tailored to your evolving needs for premium chemicals. Our complete suite of CRO services spans the entire molecule development pipeline including contract research for target identification, building blocks, compound synthesis, biochemical and cellular analysis, preclinical animal tests, and clinical studies.
      Email: Marketing
      US Email: Marketing
      Email: Sales
      US Email: Sales
      Voice: 1-631-504-6093
      Fax: 1-631-614-7828
      US Voice: 1-631-504-6093
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      Product(s):
      23832-18-0 2-,3-,10-Mercaptopinane, mixture of isomers
       
  • Charkit Chemical
    • Charkit Chemical Corporation
      The Specialty Chemical Specialists
      Explore this website to discover the products and services that Charkit provides for your industry and please contact us directly to find out how we can be of service to you.
      about: Since 1982, Charkit has been committed to expanding the markets we serve as our roster of products and services continues to grow with us. Our substantial portfolio of personal care ingredients now include a wide array of luxury and exotic components to compliment the key products we have always offered. We have expanded our offerings to the nutraceutical, industrial, and resin markets with a growing roster of versatile and unique ingredients. We continue to lead the way in our traditional markets such as Metal and Water Treatment, Imaging, Flavor & Fragrance, Aroma and Food. Our Pharmaceutical offerings continue to expand, still anchored by the Boronic Derivatives that meet the demands of Suzuki coupling reactions. Please contact us to learn how we can help you reach your goals.
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      Products List: View
      Product(s):
      MERCAPTOPINANE, 2,(3),(10)- M0150 FEMA 3503
       
  • Penta International
    • Penta International Corporation
      Chemistry innovation
      At Penta, our products and services help businesses do business better.
      For over 30 years, Penta Manufacturing Company has played a growing role in worldwide chemistry innovations and applications. As an industry leader, Penta continues to pioneer chemistry-based solutions for practically every area of commerce. Our products and expertise have helped fuel technical advances in dozens of commercial applications including flavoring, coloring, fragrances and chemical processes.
      US Email: Technical Services
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      Product(s):
      13-15800 2,3,10-MERCAPTOPINANE
       
  • Sigma-Aldrich
  • Synerzine
    • Synerzine, Inc.
      Innovation. Customization. Aroma Ingredients.
      Synerzine is a leading supplier of flavor and fragrance ingredients.
      Synerzine expresses what we have grown to embody as an organization - the synergy and connection between raw ingredients, science, technology, and the final product. Our experienced team is passionate about bringing our customers high-quality innovative ingredients that they can trust.
      Building upon our 44 year history, the Synerzine team provides customers around the globe with convenient access to over 1200 high-quality aroma ingredients. We actively engage with customers to add a wide array of new products and services on a regular basis. Our aim is to delight every customer with our exceptional services, large product selection, customization and the highest quality and safety standards. We provide our customers with true value designed to help them bring their products to market faster.
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      Products List: View
      Product(s):
      W1804 2,3-or 10-Mercaptopinane
       
  • Taytonn
    • TAYTONN PTE LTD
      Supplying Asia Pacific
      We fully understand the demands of the F&F industry and we endeavour to supply quality products, with ready availability and a personalised service.
      Since 2001 TAYTONN has been distributing key ingredients to the Fragrance and Flavor industry in Asia. We work closely with customers, principals and vendors. Together we forecast demand and match it with supply of aroma chemicals, essential oils and natural isolates & extracts. Sourced from around the world, our F&F ingredient inventory in Singapore is ready to ship to any location in Asia and beyond. Time and again, we help our principals introduce new discoveries to the F&F market - stimulating creativity and bringing value added proposition to our customers.
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      Product(s):
      2,(3),(10)-Mercaptopinane
       
Synonyms   Articles   Notes   Search
Fragrance Demo Formulas    Flavor Demo Formulas
CAS Number: 23832-18-0Picture of molecule3D/inchi
% from: 31.00%
ECHA EINECS - REACH Pre-Reg: 245-900-6
FDA UNII: X21X7U473C
Nikkaji Web: J50.533A
Beilstein Number: 4952941
MDL: MFCD00213571
CoE Number: 2332
XlogP3-AA: 3.10 (est)
Molecular Weight: 170.31846000
Formula: C10 H18 S
BioActivity Summary: listing
NMR Predictor: Predict (works with chrome or firefox)
Also(can) Contains: 10-mercaptopinane 54.00%
 3-mercaptopinane 10.00%
EFSA/JECFA Comments: Mixture of isomers (about 54 % of 10-isomer, about 31 % of 2-isomer, about 10 % of 3-isomer). (JECFA)
Category: flavor and fragrance agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar: Search
Google Books: Search
Google Scholar: with word "volatile"Search
Google Scholar: with word "flavor"Search
Google Scholar: with word "odor"Search
Perfumer and Flavorist: Search
Google Patents: Search
US Patents: Search
EU Patents: Search
Pubchem Patents: Search
PubMed: Search
NCBI: Search
JECFA Food Flavoring: 520  2,3 or 10-mercaptopinane
FLAVIS Number: 12.035 (Old)
DG SANTE Food Flavourings: 12.035  2-,3- and 10-mercaptopinane
FEMA Number: 3503  2,3 or 10-mercaptopinane
FDA:No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF):977136-05-2 ; 2,3 OR 10-MERCAPTOPINANE
Synonyms   Articles   Notes   Search   Top
Physical Properties:
Appearance: colorless to pale yellow clear liquid (est)
Assay: 95.00 to 100.00 % sum of isomers
Food Chemicals Codex Listed: No
Specific Gravity: 0.98000 to 0.98800 @  25.00 °C.
Pounds per Gallon - (est).: 8.155 to  8.221
Refractive Index: 1.51100 to 1.51700 @  20.00 °C.
Boiling Point: 142.00 °C. @ 20.00 mm Hg
Boiling Point: 258.00 to  259.00 °C. @ 760.00 mm Hg
Vapor Pressure: 0.320000 mmHg @ 25.00 °C. (est)
Vapor Density: 5.8 ( Air = 1 )
Flash Point: 208.00 °F. TCC ( 97.78 °C. )
logP (o/w): 4.272 (est)
Soluble in:
 alcohol
 water, 14.1 mg/L @ 25 °C (est)
Insoluble in:
 water
Synonyms   Articles   Notes   Search   Top
Organoleptic Properties:
 
Odor Type: sulfurous
 
Odor Strength: high ,
recommend smelling in a 0.10 % solution or less
 
 sulfurous  green  tropical  terpenic  woody  berry  seedy  buchu  
Odor Description:
at 0.10 % in dipropylene glycol. 
sulfury green tropical terpene woody berry seedy buchu
 
 sulfurous  green  tropical  terpenic  weedy  cooling  berry  seedy  buchu  
Odor Description:
Sulfureous, green, tropical, terpy and weedy, cooling, berry and seedy, buchu-like
Mosciano, Gerard P&F 18, No. 2, 38, (1993)
 
 
Flavor Type: sulfurous
 
 sulfurous  metallic  tropical  woody  fresh  green  cooling  
Taste Description:
Sulfureous, metallic, tropical, woody, fresh, green, cooling
Mosciano, Gerard P&F 18, No. 2, 38, (1993)
 
Odor and/or flavor descriptions from others (if found).
 
Frutarom
2,(3),(10)-MERCAPTOPINANE
Odor Description: Green, Terpinic, Woody
Suggested Uses: Blackcurrant, Mango, Peach, Soft Fruits, Tea, Tobacco, Tropical Fruits
Taste Description: sulfury metallic tropical woody fresh green cooling
 
Sigma-Aldrich
2-,3-,10-Mercaptopinane, mixture of isomers, FG
Odor Description: grapefruit; citrus; sulfurous
Taste Description: sulfury metallic tropical woody fresh green cooling
 
 
Synonyms   Articles   Notes   Search   Top
Cosmetic Information:
None found
Synonyms   Articles   Notes   Search   Top
Suppliers:
BOC Sciences
For experimental / research use only.
2-,3-,10-Mercaptopinane, mixture of isomers
Charkit Chemical
MERCAPTOPINANE, 2,(3),(10)- M0150 FEMA 3503
Frutarom
2,(3),(10)-MERCAPTOPINANE
Odor: Green, Terpinic, Woody
Use: Suggested Uses: Blackcurrant, Mango, Peach, Soft Fruits, Tea, Tobacco, Tropical Fruits
Penta International
2,3,10-MERCAPTOPINANE
Sigma-Aldrich
2-,3-,10-Mercaptopinane, mixture of isomers, FG
Odor: grapefruit; citrus; sulfurous
Certified Food Grade Products
Synerzine
2,3-or 10-Mercaptopinane
Taytonn
2,(3),(10)-Mercaptopinane
Odor: Woody, Green, Terpinic
Synonyms   Articles   Notes   Search   Top
Safety Information:
Preferred SDS: View
European information :
Most important hazard(s):
Xi - Irritant
R 36/38 - Irritating to skin and eyes.
S 02 - Keep out of the reach of children.
S 24/25 - Avoid contact with skin and eyes.
S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S 37/39 - Wear suitable gloves and eye/face protection.
 
Hazards identification
 
Classification of the substance or mixture
GHS Classification in accordance with 29 CFR 1910 (OSHA HCS)
None found.
GHS Label elements, including precautionary statements
 
Pictogram
 
Hazard statement(s)
None found.
Precautionary statement(s)
None found.
Oral/Parenteral Toxicity:
intravenous-mouse LD50  100 mg/kg
U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#00420

Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
Synonyms   Articles   Notes   Search   Top
Safety in Use Information:
Category: flavor and fragrance agents
Recommendation for mango thiol usage levels up to:
  0.0500 % in the fragrance concentrate.
 
Maximised Survey-derived Daily Intakes (MSDI-EU): 0.037 (μg/capita/day)
Structure Class: II
Use levels for FEMA GRAS flavoring substances on which the FEMA Expert Panel based its judgments that the substances are generally recognized as safe (GRAS).
The Expert Panel also publishes separate extensive reviews of scientific information on all FEMA GRAS flavoring substances and can be found at FEMA Flavor Ingredient Library
publication number: 10
Click here to view publication 10
 average usual ppmaverage maximum ppm
baked goods: -0.03000
beverages(nonalcoholic): -0.03000
beverages(alcoholic): --
breakfast cereal: --
cheese: --
chewing gum: --
condiments / relishes: --
confectionery froastings: -0.03000
egg products: --
fats / oils: --
fish products: --
frozen dairy: -0.02000
fruit ices: -0.02000
gelatins / puddings: -0.01000
granulated sugar: --
gravies: --
hard candy: --
imitation dairy: --
instant coffee / tea: --
jams / jellies: --
meat products: --
milk products: --
nut products: --
other grains: --
poultry: --
processed fruits: --
processed vegetables: --
reconstituted vegetables: --
seasonings / flavors: --
snack foods: --
soft candy: --
soups: --
sugar substitutes: --
sweet sauces: --
Synonyms   Articles   Notes   Search   Top
Safety References:
European Food Safety Athority(efsa): Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies...
European Food Safety Authority (EFSA) reference(s):
Flavouring Group Evaluation 8 (FGE.08)[1]: Aliphatic and alicyclic mono-, di-, tri-, and polysulphides with or without additional oxygenated functional groups from chemical group 20
View page or View pdf
Flavouring Group Evaluation 8, Revision 1 (FGE.08Rev1): Aliphatic and alicyclic mono-, di-, tri-, and polysulphides with or without additional oxygenated functional groups from chemical groups 20 and 30
View page or View pdf
Scientific Opinion on Flavouring Group Evaluation 8, Revision 3 (FGE.08Rev3): Aliphatic and alicyclic mono-, di-, tri-, and polysulphides with or without additional oxygenated functional groups from chemical groups 20 and 30
View page or View pdf
Scientific Opinion on Flavouring Group Evaluation 08, Revision 4 (FGE.08Rev4): Aliphatic and alicyclic mono-, di-, tri-, and polysulphides with or without additional oxygenated functional groups from chemical groups 20 and 30
View page or View pdf
EPI System: View
EPA Substance Registry Services (TSCA): 23832-18-0
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 90984
National Institute of Allergy and Infectious Diseases: Data
WGK Germany: 3
 2,7,7-trimethylbicyclo[3.1.1]heptane-2-thiol
Chemidplus: 0023832180
RTECS: TK4575000 for cas# 23832-18-0
Synonyms   Articles   Notes   Search   Top
References:
 2,7,7-trimethylbicyclo[3.1.1]heptane-2-thiol
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 23832-18-0
Pubchem (cid): 90984
Pubchem (sid): 135047579
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Other Information:
(IUPAC): Atomic Weights of the Elements 2009
(IUPAC): Atomic Weights of the Elements 2009 (pdf)
Videos: The Periodic Table of Videos
tgsc: Atomic Weights use for this web site
(IUPAC): Periodic Table of the Elements
FDA Substances Added to Food (formerly EAFUS): View
HMDB (The Human Metabolome Database): HMDB32377
FooDB: FDB009794
ChemSpider: View
FAO: 2, 3, and 10-Mercaptopinane
Synonyms   Articles   Notes   Search   Top
Potential Blenders and core components note
 
For Odor
No odor group found for these
3-benzoyl pyridine 
2-ethyl-N-methyl-N-(3-methyl phenyl) butyramideFR
(N-methyl-pyrryl-2)-methylthiol acetate 
 vinyl (4-methyl-thiazolyl-2) carbinol 
2-methyl-2-pentenoic acidFL/FR
alliaceous
 ferula assa-foetida gum oilFL/FR
balsamic
 fir balsam absoluteFR
 fir balsam concreteFR
 frankincense absoluteFL/FR
 juniper berry absoluteFL/FR
chemical
 propyl propionateFL/FR
citrus
 bergamot acetoacetateFR
 ocimene quintoxideFL/FR
ethereal
 cyclohexyl formateFL/FR
fatty
 allyl octanoateFL/FR
floral
 cassis specialtyFR
 citronellyl butyrateFL/FR
alpha-damasconeFL/FR
 dihydro-alpha-iononeFL/FR
 greenhouse fragranceFR
beta-ironeFL/FR
 lily propanolFR
beta-ocimeneFL/FR
(Z)-beta-ocimeneFL/FR
 petitgrain oil fractionsFR
 phenethyl butyrateFL/FR
 rose butanoateFL/FR
 rose carboxylateFR
fruity
 apple ketalFL/FR
3-benzyl-4-heptanoneFL/FR
 bisaboleneFL/FR
 butyl isobutyrateFL/FR
 citronellyl isobutyrateFL/FR
 cyclohexyl carboxylic acidFL/FR
(E)-beta-damasconeFL/FR
(E)-alpha-damasconeFL/FR
 decen-1-yl cyclopentanoneFL/FR
 dihydroactinidolideFL/FR
 grape butyrateFL/FR
beta-ionone epoxideFL/FR
 pineapple hydroxyhexanoateFL/FR
 propyl hexanoateFL/FR
green
(Z)-3-hepten-1-yl acetateFL/FR
 hexanal (aldehyde C-6)FL/FR
 manzanate (Givaudan)FL/FR
para-methyl hydratropaldehydeFL/FR
3,5,5-trimethyl hexanolFL/FR
2,2,4-trimethyl-1,3-oxathiane 
herbal
 anthemis nobilis flower extractFL/FR
 buchu oximeFR
(S)-campholene acetateFL/FR
isodihydrolavandulalFL/FR
 eucalyptus radiata leaf/stem oilFR
6-hydroxydihydrotheaspirane (mixture of isomers)FL/FR
 hyssop oilFL/FR
2-pentyl acetateFL/FR
 sabinene hydrateFL/FR
 terpinoleneFL/FR
 thyme oil wild or creepingFL/FR
malty
S-methyl methioninium chloride 
melon
(Z)-6-nonen-1-yl acetateFL/FR
minty
dextro-dihydrocarvoneFL/FR
 diosphenolFL/FR
 peppermint oil americaFL/FR
 peppermint oil idahoFL/FR
(R)-(+)-pulegoneFR
 spearmint oil americaFL/FR
spicy
 angelica oilFL/FR
 croton eluteria bark oilFL/FR
 ginger root oil brazilFL/FR
 ginger root oil chinaFL/FR
 ginger root oil cochinFL/FR
 myrtenalFL/FR
 nutmeg absoluteFL/FR
black pepper oilFL/FR
sulfurous
 buchu mercaptanFL/FR
 cassis pentanoneFL/FR
2,4-dimethyl-1,3-dithiolane 
1,2-dithiane 
 lychee mercaptan acetateFL/FR
(S)-1-methoxy-3-heptane thiolFL/FR
3-(methyl thio) hexanolFL/FR
 passiflora acetateFL/FR
2-phenethyl isothiocyanateFL/FR
terpenic
 juniperus communis fruit oilFL/FR
tropical
 ethyl (Z)-3-hexenoateFL/FR
cis-galbanum oxathianeFL/FR
2-tropical oxathianeFL/FR
waxy
 nonyl acetateFL/FR
 orris rhizome oil CO2 extractFL/FR
woody
 juniper berry oleoresinFL/FR
lariciu pine needle oilFR
alpha-terpineneFL/FR
 
For Flavor
 
No flavor group found for these
 butyl isothiocyanateFL
 dihydroactinidolideFL/FR
 diosphenolFL/FR
 ethyl (Z)-3-hexenoateFL/FR
 ethyl 2-(methyl thio) acetateFL
(Z)-3-hepten-1-yl acetateFL/FR
beta-ionone epoxideFL/FR
2-methyl-5-methoxythiazoleFL
2-phenethyl isothiocyanateFL/FR
2,2,4-trimethyl-1,3-oxathiane 
2,4,4-trimethyl-1,3-oxathianeFL
2-tropical oxathianeFL/FR
alliaceous
 ferula assa-foetida gum oilFL/FR
balsamic
 juniper berry absoluteFL/FR
berry
 dihydro-alpha-iononeFL/FR
(S)-1-methoxy-3-heptane thiolFL/FR
camphoreous
6-hydroxydihydrotheaspirane (mixture of isomers)FL/FR
citrus
 bisaboleneFL/FR
cooling
 manzanate (Givaudan)FL/FR
 peppermint oil americaFL/FR
 sabinene hydrateFL/FR
dairy
2-pentyl acetateFL/FR
ethereal
4-hexen-3-oneFL
fatty
 allyl octanoateFL/FR
floral
beta-ironeFL/FR
fruity
 apple ketalFL/FR
3-benzyl-4-heptanoneFL/FR
 butyl isobutyrateFL/FR
 citronellyl butyrateFL/FR
 citronellyl isobutyrateFL/FR
 cyclohexyl carboxylic acidFL/FR
alpha-damasconeFL/FR
(E)-beta-damasconeFL/FR
(E)-alpha-damasconeFL/FR
 decen-1-yl cyclopentanoneFL/FR
(Z)-3-nonen-1-yl acetateFL
 phenethyl butyrateFL/FR
 pineapple hydroxyhexanoateFL/FR
 propyl hexanoateFL/FR
 rose butanoateFL/FR
garlic
1,2-dithiane 
green
3-benzoyl pyridine 
 cassis pentanoneFL/FR
 cyclohexyl formateFL/FR
dextro-dihydrocarvoneFL/FR
cis-galbanum oxathianeFL/FR
 grape butyrateFL/FR
 hexanal (aldehyde C-6)FL/FR
para-methyl hydratropaldehydeFL/FR
(Z)-6-nonen-1-yl acetateFL/FR
beta-ocimeneFL/FR
(Z)-beta-ocimeneFL/FR
 ocimene quintoxideFL/FR
3,5,5-trimethyl hexanolFL/FR
herbal
 anthemis nobilis flower extractFL/FR
isodihydrolavandulalFL/FR
 hyssop oilFL/FR
 thyme oil wild or creepingFL/FR
jammy
(S)-campholene acetateFL/FR
juicy
 lychee mercaptan acetateFL/FR
medicinal
 frankincense absoluteFL/FR
metallic
3-(methyl thio) hexanolFL/FR
(N-methyl-pyrryl-2)-methylthiol acetate 
minty
 myrtenalFL/FR
 peppermint oil idahoFL/FR
 spearmint oil americaFL/FR
onion
2,4-dimethyl-1,3-dithiolane 
sour
2-methyl-2-pentenoic acidFL/FR
spicy
 angelica oilFL/FR
 croton eluteria bark oilFL/FR
 ginger root oil brazilFL/FR
 ginger root oil chinaFL/FR
 ginger root oil cochinFL/FR
 nutmeg absoluteFL/FR
black pepper oilFL/FR
sulfurous
 buchu mercaptanFL/FR
 diallyl trisulfideFL
 methyl 2-(methyl thio) butyrateFL
S-methyl methioninium chloride 
terpenic
 juniperus communis fruit oilFL/FR
alpha-terpineneFL/FR
tropical
 passiflora acetateFL/FR
 propyl propionateFL/FR
vegetable
 potato butyraldehydeFL
waxy
 nonyl acetateFL/FR
 juniper berry oleoresinFL/FR
 orris rhizome oil CO2 extractFL/FR
 terpinoleneFL/FR
 vinyl (4-methyl-thiazolyl-2) carbinol 
 
Synonyms   Articles   Notes   Search   Top
Potential Uses:
 currant black currantFR
 fruit tropical fruitFL
 guavaFR
 mangoFR
 peachFR
 raspberryFR
Synonyms   Articles   Notes   Search   Top
Occurrence (nature, food, other): note
 not found in nature
Synonyms   Articles   Notes   Search   Top
Synonyms:
 bicyclo[3.1.1]heptane-2-thiol, 2,6,6-trimethyl-
2-mercaptopinane
2-,3- and 10-mercaptopinane
2-,3-,10-mercaptopinane
2,(3),(10)-mercaptopinane
2,3 or 10-mercaptopinane
2,3-or 10-mercaptopinane
2,3,10-mercaptopinane
2,3(10)-mercaptopinane
 pinane thiol
2-pinane thiol
 pinane, 2-mercapto-
2-pinanethiol
 pinanyl mercaptan
 pinanylmercaptan
2,6,6-trimethyl bicyclo(3.1.1)heptane-2-thiol
2,6,6-trimethylbicyclo(3.1.1)heptane-2-thiol
2,6,6-trimethylbicyclo[3.1.1]heptane-2-thiol
2,7,7-trimethylbicyclo[3.1.1]heptane-2-thiol
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Synonyms   Articles   Notes   Search   Top
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