S-(methyl thio) hexanoate
S-methyl hexanethioate
 
Notes:
None found
  • 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.
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      Product(s):
      2432-77-1 S-Methyl thiohexanoate
       
  • 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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      Product(s):
      METHYL THIOHEXANOATE M2934
       
  • Endeavour Specialty Chemicals
    • Endeavour Specialty Chemicals Ltd
      Expertise in high impact aroma chemicals
      Endeavour Speciality Chemicals offers high-impact aroma chemicals, at small to medium scale.
      Speciality Chemical has more than 25 years experience of manufacturing high-impact aroma chemicals. With our core expertise in sulfur and heterocyclic chemistries, Endeavours products have applications in a range of industry sectors including flavours and fragrances, pharmaceutical research and material sciences. Endeavour also offer custom synthesis and contract manufacturing services at their UK manufacturing site.
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      Product(s):
      TE0110 S-Methyl thiohexanoate 99% F&F
       
  • Excellentia International
    • Excellentia International
      Ingredients by Nature
      Exceptional quality and excellence in meeting our customers requirements.
      Excellentia International was founded in 2010 through the merger of Excellentia Flavors LLC and Polarome International. Collectively, these companies account for more than one hundred years of industry experience, and are recognized for exceptional quality and excellence in meeting our customers’ requirements.
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      Product(s):
      Methyl ThioHexanoate Natural
       
  • Penta International
  • Robinson Brothers
  • Taytonn ASCC
    • Taytonn ASCC 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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      Methyl Thiohexanoate
       
  • R C Treatt & Co Ltd
    • R C Treatt and Co Ltd
      Innovative ingredient solutions
      World-leading innovative ingredient solutions provider for the flavour, fragrance and FMCG industries.
      We offer innovative and trend-setting product concepts for our customers, collaborating with them to create true value for their products.
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      Product(s):
      S-Methyl hexanethioate Halal, Kosher

      Useful in passionfruit, tropical fruit, guava, grapefruit in dilution. Also used in vegetable, savoury, tropical fruit, pineapple and cheese flavours. Odour threshold in water: 0.3 ppb. From a range of S-methyl thioesters.
       
       
Synonyms   Articles   Notes   Search
CAS Number: 2432-77-1Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg: 219-410-8
FDA UNII: MC7G128ACI
Nikkaji Web: J125.770F
MDL: MFCD03426527
XlogP3-AA: 2.60 (est)
Molecular Weight: 146.25278000
Formula: C7 H14 O S
NMR Predictor: Predict (works with chrome, Edge or firefox)
Category: flavoring 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
FEMA Number: 3862 S-methyl hexanethioate
FDA:No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF):2432-77-1 ; S-METHYL HEXANETHIOATE
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Physical Properties:
Appearance: colorless clear liquid (est)
Assay: 96.00 to 100.00 % 
Food Chemicals Codex Listed: No
Specific Gravity: 0.93500 to 0.94500 @  20.00 °C.
Pounds per Gallon - (est).: 7.789 to  7.873
Refractive Index: 1.45800 to 1.46800 @  20.00 °C.
Boiling Point: 120.00 to  122.00 °C. @ 0.00 mm Hg
Boiling Point: 187.00 to  188.00 °C. @ 760.00 mm Hg
Vapor Pressure: 0.638000 mmHg @ 25.00 °C. (est)
Flash Point: 125.00 °F. TCC ( 51.67 °C. )
logP (o/w): 2.897 (est)
Soluble in:
 alcohol
 water, 1066 mg/L @ 25 °C (est)
Insoluble in:
 water
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Organoleptic Properties:
 
Odor Type: fruity
 
 fruity  ethereal  green  tropical  cabbage  cheesy  rancid  floral  green  
Odor Description:
at 0.10 % in dipropylene glycol. 
fruity ethereal green tropical cabbage cheesy rancid floral green
 
Odor and/or flavor descriptions from others (if found).
 
R C Treatt & Co Ltd
S-Methyl hexanethioate Halal, Kosher
Odor Description: Cabbage, ripe Camembert, rancid, floral green (grass, mature pineapple)
Taste Description: fruity
Useful in passionfruit, tropical fruit, guava, grapefruit in dilution. Also used in vegetable, savoury, tropical fruit, pineapple and cheese flavours. Odour threshold in water: 0.3 ppb. From a range of S-methyl thioesters.
 
 
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Cosmetic Information:
None found
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Suppliers:
BOC Sciences
For experimental / research use only.
S-Methyl thiohexanoate
Carbosynth
For experimental / research use only.
S-Methyl thiohexanoate
Charkit Chemical
METHYL THIOHEXANOATE M2934
Endeavour Specialty Chemicals
S-Methyl thiohexanoate 99% F&F
Speciality Chemical Product Groups
Excellentia International
Methyl ThioHexanoate Natural
Penta International
S-METHYL HEXANETHIOATE NATURAL 1% IN ETHYL ALCOHOL
Penta International
S-METHYL HEXANETHIOATE NATURAL NEAT
Penta International
S-METHYL HEXANETHIOATE
R C Treatt & Co Ltd
S-Methyl hexanethioate
Halal, Kosher
Odor: Cabbage, ripe Camembert, rancid, floral green (grass, mature pineapple)
Flavor: fruity
Useful in passionfruit, tropical fruit, guava, grapefruit in dilution. Also used in vegetable, savoury, tropical fruit, pineapple and cheese flavours. Odour threshold in water: 0.3 ppb. From a range of S-methyl thioesters.
Robinson Brothers
S-Methyl thiohexanoate F&F
https://www.robinsonbrothers.uk/chemistry-competences
Taytonn ASCC
Methyl Thiohexanoate
Odor: Fruity, Green, Sulphurous
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Safety Information:
European information :
Most important hazard(s):
Xi - Irritant
R 10 - Flammable.
R 36/38 - Irritating to skin and eyes.
S 02 - Keep out of the reach of children.
S 16 - Keep away from sources of ignition - No Smoking.
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:
Not determined
Dermal Toxicity:
Not determined
Inhalation Toxicity:
Not determined
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Safety in Use Information:
Category: flavoring agents
Recommendation for S-(methyl thio) hexanoate usage levels up to:
 not for fragrance use.
 
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: 18
Click here to view publication 18
 average usual ppmaverage maximum ppm
baked goods: 0.100005.00000
beverages(nonalcoholic): 0.100005.00000
beverages(alcoholic): --
breakfast cereal: 0.100005.00000
cheese: --
chewing gum: --
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: 0.100005.00000
fruit ices: --
gelatins / puddings: --
granulated sugar: --
gravies: 0.100005.00000
hard candy: --
imitation dairy: --
instant coffee / tea: --
jams / jellies: --
meat products: 0.100005.00000
milk products: 0.100005.00000
nut products: --
other grains: --
poultry: --
processed fruits: --
processed vegetables: --
reconstituted vegetables: --
seasonings / flavors: 100.000001000.00000
snack foods: --
soft candy: 0.100005.00000
soups: 0.100005.00000
sugar substitutes: --
sweet sauces: 0.100005.00000
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Safety References:
EPI System: View
AIDS Citations: Search
Cancer Citations: Search
Toxicology Citations: Search
EPA Substance Registry Services (TSCA): 2432-77-1
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 75515
National Institute of Allergy and Infectious Diseases: Data
WISER: UN 3272
WGK Germany: 3
 S-methyl hexanethioate
Chemidplus: 0002432771
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References:
 S-methyl hexanethioate
NIST Chemistry WebBook: Search Inchi
Pubchem (cid): 75515
Pubchem (sid): 135032442
Pherobase: View
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Other Information:
(IUPAC): Atomic Weights of the Elements 2011 (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): HMDB39465
FooDB: FDB019069
Export Tariff Code: 2915.60.9000
VCF-Online: VCF Volatile Compounds in Food
ChemSpider: View
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Potential Blenders and core components note
 
For Odor
acidic
2-ethyl butyric acidFL/FR
alcoholic
 fusel oilFL/FR
caramellic
 maltyl isobutyrateFL/FR
chemical
isobutyl formateFL/FR
citrus
 grapefruit mercaptanFL/FR
coconut
delta-octalactoneFL/FR
ethereal
 acetalFL/FR
 butyl acetateFL/FR
 ethyl acetateFL/FR
 ethyl pyruvateFL/FR
 methyl acetateFL/FR
 methyl ethyl ketoneFL/FR
2-methyl valeraldehydeFL/FR
isopropyl acetateFL/FR
isopropyl formateFL/FR
 propyl valerateFL/FR
isovaleraldehyde propylene glycol acetalFL/FR
fatty
 allyl octanoateFL/FR
floral
 benzyl isobutyrateFL/FR
 citronellyl acetateFL/FR
 geranyl propionateFL/FR
 nonan-3-yl acetateFL/FR
beta-ocimeneFL/FR
 phenethyl acetateFL/FR
 rose butanoateFL/FR
fruity
 acetaldehyde diisoamyl acetalFL/FR
 allyl butyrateFL/FR
 allyl hexanoateFL/FR
 allyl propionateFL/FR
 amyl acetateFL/FR
 amyl butyrateFL/FR
 amyl formateFL/FR
 amyl heptanoateFL/FR
isoamyl isovalerateFL/FR
isoamyl propionateFL/FR
 benzyl methyl etherFL/FR
 berry pentadienoateFL/FR
isobutyl acetateFL/FR
isobutyl isobutyrateFL/FR
 butyl valerateFL/FR
isobutyl valerateFL/FR
 cyclohexyl carboxylic acidFL/FR
 ethyl 2-octenoateFL/FR
2-ethyl butyl acetateFL/FR
 ethyl propionateFL/FR
 geranyl ethyl etherFL/FR
3-mercaptohexyl acetateFL/FR
 methyl 2-methyl butyrateFL/FR
 methyl 2-methyl valerateFL/FR
 methyl butyrateFL/FR
 methyl hexanoateFL/FR
 methyl isobutyrateFL/FR
 methyl nonanoateFL/FR
2-pentanoneFL/FR
isopropyl 2-methyl butyrateFL/FR
 propyl hexanoateFL/FR
 propyl isobutyrateFL/FR
isopropyl propionateFL/FR
 strawberry furanone butyrateFL/FR
 tetrahydrofurfuryl butyrateFL/FR
 tropical iononeFL/FR
 tropical thiazoleFL/FR
 tropical trithianeFL/FR
green
 cognac heptanoneFL/FR
 ethyl (E,Z)-2,4-decadienoateFL/FR
 heptanal dimethyl acetalFL/FR
(Z)-3-hexen-1-yl phenyl acetateFL/FR
 hexyl 2-methyl butyrateFL/FR
(Z)-2-penten-1-olFL/FR
1-penten-3-olFL/FR
 terpinyl propionateFL/FR
herbal
 jambu oleoresinFL/FR
 viridiflorolFL/FR
phenolic
2'-hydroxyacetophenoneFL/FR
sulfurous
 buchu mercaptanFL/FR
 cassis pentanoneFL/FR
 grapefruit menthaneFL/FR
 lychee mercaptan acetateFL/FR
 mango thiolFL/FR
 passiflora acetateFL/FR
1-phenethyl mercaptanFL/FR
S-tropical 2-thiobutyrateFL/FR
terpenic
gamma-terpineneFL/FR
tropical
 genet absoluteFL/FR
 hexyl 2-methyl-3-pentenoateFL/FR
 hotrienolFL/FR
 tropical 3-thiobutyrateFL/FR
2-tropical oxathianeFL/FR
waxy
 ethyl nonanoateFL/FR
 nonyl acetateFL/FR
yeasty
2-octen-4-oneFL/FR
 
For Flavor
 
No flavor group found for these
 acetaldehyde diisoamyl acetalFL/FR
isoamyl 3-methyl thiopropionateFL
 butyl methyl ketoneFL
 ethyl 2-methyl-2-(methyl thio) propionateFL
 ethyl 3-octenoateFL
 geranyl ethyl etherFL/FR
2-heptenoic acidFL
2-methyl butyl isobutyrateFL
2-methyl butyl propionateFL
 nonan-3-yl acetateFL/FR
1-phenethyl mercaptanFL/FR
 propyl valerateFL/FR
S-tropical 2-thiobutyrateFL/FR
 viridiflorolFL/FR
acidic
2-ethyl butyric acidFL/FR
 propionic acidFL
alliaceous
 allyl propionateFL/FR
 dipropyl trisulfideFL
 tropical thiazoleFL/FR
chemical
 methyl ethyl ketoneFL/FR
citrus
 cognac heptanoneFL/FR
 grapefruit mercaptanFL/FR
coconut
delta-octalactoneFL/FR
cooling
 jambu oleoresinFL/FR
ethereal
 butyl acetateFL/FR
 ethyl acetateFL/FR
 methyl acetateFL/FR
 methyl isobutyrateFL/FR
isopropyl acetateFL/FR
fatty
 allyl octanoateFL/FR
floral
 citronellyl acetateFL/FR
 hotrienolFL/FR
 tropical iononeFL/FR
fruity
 allyl hexanoateFL/FR
 amyl acetateFL/FR
 amyl butyrateFL/FR
 amyl formateFL/FR
 amyl heptanoateFL/FR
isoamyl propionateFL/FR
 benzyl isobutyrateFL/FR
 benzyl methyl etherFL/FR
 berry pentadienoateFL/FR
isobutyl acetateFL/FR
isobutyl isobutyrateFL/FR
isobutyl valerateFL/FR
 butyl valerateFL/FR
 cyclohexyl carboxylic acidFL/FR
 ethyl 2-octenoateFL/FR
2-ethyl butyl acetateFL/FR
 ethyl propionateFL/FR
 fusel oilFL/FR
 hexyl 2-methyl-3-pentenoateFL/FR
3-mercaptohexyl hexanoateFL
 methyl 2-methyl butyrateFL/FR
 methyl 2-methyl valerateFL/FR
2-methyl allyl butyrateFL
 methyl hexanoateFL/FR
2-pentanoneFL/FR
isopropyl 2-methyl butyrateFL/FR
isopropyl formateFL/FR
 propyl hexanoateFL/FR
 propyl isobutyrateFL/FR
isopropyl propionateFL/FR
 rose butanoateFL/FR
 strawberry furanone butyrateFL/FR
 tetrahydrofurfuryl butyrateFL/FR
 tropical trithianeFL/FR
isovaleraldehyde propylene glycol acetalFL/FR
fusel
 methyl butyrateFL/FR
green
 allyl butyrateFL/FR
isoamyl isovalerateFL/FR
 cassis pentanoneFL/FR
 ethyl (E,Z)-2,4-decadienoateFL/FR
2-ethyl butyraldehydeFL
 heptanal dimethyl acetalFL/FR
(Z)-3-hexen-1-yl phenyl acetateFL/FR
 hexyl 2-methyl butyrateFL/FR
beta-ocimeneFL/FR
(Z)-2-penten-1-olFL/FR
1-penten-3-olFL/FR
 terpinyl propionateFL/FR
hay
 genet absoluteFL/FR
honey
 phenethyl acetateFL/FR
jammy
 maltyl isobutyrateFL/FR
juicy
 lychee mercaptan acetateFL/FR
meaty
3-mercapto-2-butanoneFL
naphthyl
2'-hydroxyacetophenoneFL/FR
nutty
 acetalFL/FR
oily
 tetrahydrofurfuryl propionateFL
rummy
isobutyl formateFL/FR
 ethyl pyruvateFL/FR
sulfurous
 buchu mercaptanFL/FR
 grapefruit menthaneFL/FR
 mango thiolFL/FR
 methyl 2-(methyl thio) butyrateFL
 methyl thiomethyl butyrateFL
 tropical 3-thiobutyrateFL/FR
terpenic
gamma-terpineneFL/FR
tropical
3-mercaptohexyl acetateFL/FR
3-mercaptohexyl butyrateFL
 passiflora acetateFL/FR
2-tropical oxathianeFL/FR
vegetable
2-methyl valeraldehydeFL/FR
2-octen-4-oneFL/FR
waxy
 ethyl nonanoateFL/FR
 geranyl propionateFL/FR
 nonyl acetateFL/FR
winey
 methyl nonanoateFL/FR
 
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Potential Uses:
 cheeseFL
 citrusFL
 dairyFL
 fruit tropical fruitFL
 grapefruitFR
 guavaFR
 passion fruitFR
 pineappleFL
 savoryFL
 vegetableFL
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Occurrence (nature, food, other): note
 hop oil
Search Trop  Picture
 mushroom
Search  PMC Picture
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Synonyms:
 hexane thioic acid S-methyl ester
 hexanethioic acid, S-methyl ester
S-methane thiol caproate
S-methanethiol caproate
S-methyl hexane thioate
S-methyl hexanethioate
S-methyl thiohexanoate
S-(methylthio)hexanoate
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