isopropyl hexanoate
hexanoic acid, isopropyl ester
 
Notes:
Present in wine grapes, strawberry, starfruit (Averrhoa carambala), blue cheeses, gruyere de comte cheese and Parmesan cheese. Flavouring ingredient
  • CTC Organics
    • CTC Organics
      For More Than 40 Year
      Your source for rare aroma chemicals for the flavor and fragrance industy.
      “The world is run by middle men.” The number of times I have heard Dr. Liu utter those words are innumerable. He loved reciting and recording famous quotes and had many of his own. Among his many talents, Dr. Liu had a unique genius in the area of chemistry. He had an uncanny understanding of the pulse of the chemical industry and was a superb salesman.
      US Email: Customer Service
      US Voice: (404) 524-6744
      US Fax: (404) 577-1651
      Resources
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      Product(s):
      W100 isopropyl hexanoate
       
  • ECSA Chemicals
    • ECSA Chemicals
      International trading and distribution
      ECSA Group offers its customers in these business segments a complete 'one-stop shopping' solution.
      A hundred years on from its establishment, the Emanuele Centonze Holding SA has developed a solid presence in Switzerland and in Europe. The Group currently includes: ECSA Chemicals AG/ECSA Italia SRL SocietÓ con Unico Socio – ECSA Maintenance AG – ECSA Energy SA – Porta Ticino Easy Stop SA. The Group operates in the distribution of chemical and petroleum products, in the international trading of commodities, and in the distribution of maintenance systems. With 285 employees, a consolidated turnover of 335 million Swiss Francs in 2015, and more than 15,000 active customers, the Group ranks among the top 500 companies in Switzerland. ECSA operates in Switzerland and the EU, and in particular has consolidated its geographical position on the main axis linking northern and southern Europe, thus creating a competitive and privileged logistical hub.
      Email: Info
      Email: Sales
      Email: Trading
      Email: Maintenance
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      Fax: +41 91 695 88 01
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      Company Profile
      Products List: View
      Product(s):
      isoPropyl Caproate
       
  • Frutarom
    • Frutarom Ltd
      Discover Our Passion
      Your preferred partner for flavour and fragrance success.
      At Frutarom, we take pride in our expertise and knowledge of Flavour & Fragrance Ingredients and our thorough understanding of the needs of Flavourists, Perfumers and Food Technologists. Working closely with our customers we have a strong track record of providing unique solutions to fulfil requirements.
      US Email: Info- USA
      Email: Info - UK
      Voice: +44 (0) 1429 863 222
      US Voice: +1 513 870 4900
      Products List: View
      Product(s):
      I1550-3 isoPROPYL HEXANOATE
       
  • Lluch Essence
    • Lluch Essence S.L.
      A family company dedicated to sales and distribution
      Flexibility, availability, price and quality.
      Flexibility, availability, price and quality make LLUCH ESSENCE S.L. one of Europe’s references when it comes to essential oils and aroma chemicals, and it is now well known all around the world.
      Email: Info
      Voice: 34 93 379 38 49
      Fax: 34 93 370 65 04
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      Product(s):
      isoPROPYL CAPROATE 98%
       
  • 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
      US Email: Sales
      US Voice: (973) 740-2300
      US Fax: (973) 740-1839
      Product(s):
      09-54100 ISOPROPYL CAPROATE, Kosher
       
  • SRS Aromatics
    • SRS Aromatics Ltd
      For over 25 years
      Bringing flavour and fragrance into your world.
      As suppliers / distributors of ingredients to the fragrance and flavour industries, our goal is to provide high quality materials at competitive prices with an exceptional level of service. Established in 1984, SRS Aromatics Ltd is an independent family owned business which has become very well-respected within the fragrance and flavour industry as a reliable and trustworthy partner. Over the years this has allowed the company to develop strong relationships with many global manufacturers; several of whom we represent in the UK. A core aim of our business is to work extremely closely with both our suppliers and customers to maximise service levels with minimum disruption to supply.
      Email: Info
      Email: Sales
      Voice: +44 (0) 1284 704076
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      Product(s):
      isoPROPYL CAPROATE
       
  • Ernesto Ventós
Synonyms   Articles   Notes   Search
propan-2-yl hexanoate (Click)
CAS Number: 2311-46-8Picture of molecule
ECHA EINECS - REACH Pre-Reg: 219-000-9
FDA UNII: 84AO2UI60U
Nikkaji Web: J149.309D
MDL: MFCD00059436
CoE Number: 312
XlogP3-AA: 2.80 (est)
Molecular Weight: 158.24086000
Formula: C9 H18 O2
NMR Predictor: Predict (works with chrome or firefox)
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
IBM Patents: Obtain
Obtain
Pubchem Patents: Search
PubMed: Search
NCBI: Search
JECFA Food Flavoring: 308  isopropyl hexanoate
Flavis Number: 09.062 (Old)
DG SANTE Food Flavourings: 09.062  isopropyl hexanoate
FEMA Number: 2950  isopropyl hexanoate
FDA Mainterm: ISOPROPYL HEXANOATE
FDA Regulation:
FDA PART 172 -- FOOD ADDITIVES PERMITTED FOR DIRECT ADDITION TO FOOD FOR HUMAN CONSUMPTION
Subpart F--Flavoring Agents and Related Substances
Sec. 172.515 Synthetic flavoring substances and adjuvants.
Synonyms   Articles   Notes   Search   Top
Physical Properties:
Appearance: colorless clear liquid (est)
Assay: 97.00 to 100.00 % 
Food Chemicals Codex Listed: No
Boiling Point: 172.00 to  173.00 °C. @ 760.00 mm Hg
Boiling Point: 74.00 °C. @ 20.00 mm Hg
Vapor Pressure: 1.090000 mm/Hg @ 25.00 °C. (est)
Flash Point: 120.00 °F. TCC ( 48.89 °C. )
logP (o/w): 3.177 (est)
Soluble in:
 alcohol
 water, 117.8 mg/L @ 25 °C (est)
Insoluble in:
 water
Similar Items: note
allyl hexanoate
allyl thiohexanoate
amyl hexanoate
isoamyl hexanoate
para-anisyl hexanoate
benzyl hexanoate
butyl hexanoate
isobutyl hexanoate
sec-butyl hexanoate
cinnamyl hexanoate
citronellyl hexanoate
meta-cresyl hexanoate
para-cresyl hexanoate
cyclohexyl hexanoate
decyl hexanoate
dimethyl benzyl carbinyl hexanoate
ethyl 2-acetyl hexanoate
ethyl hexanoate
furfuryl hexanoate
geranyl hexanoate
heptyl hexanoate
sec-heptyl hexanoate
(E)-3-hexen-1-yl hexanoate
(E)-2-hexen-1-yl hexanoate
(Z)-3-hexen-1-yl hexanoate
hexyl hexanoate
linalyl hexanoate
menthyl hexanoate
3-mercaptohexyl hexanoate
2-methyl butyl hexanoate
methyl hexanoate
methyl thiohexanoate
neryl hexanoate
octyl hexanoate
(Z)-2-penten-1-yl hexanoate
phenethyl hexanoate
3-phenyl propyl hexanoate
prenyl hexanoate
propyl hexanoate
sulfuryl hexanoate
Synonyms   Articles   Notes   Search   Top
Organoleptic Properties:
Odor Type: fruity
Odor Strength: medium ,
recommend smelling in a 10.00 % solution or less
 fruity  pineapple  loganberry  berry  
Odor Description:
at 10.00 % in dipropylene glycol. 
fruity pineapple loganberry berry
 berry  
Taste Description:
berry
  
Synonyms   Articles   Notes   Search   Top
Cosmetic Information:
CosIng: cosmetic data
Cosmetic Uses: perfuming agents
Synonyms   Articles   Notes   Search   Top
Suppliers:
CTC Organics
isopropyl hexanoate
ECSA Chemicals
isoPropyl Caproate
Company Profile
Ernesto Ventós
IsoPROPYL HEXANOATE
Odor: SWEET, FRUITY. PINEAPPLE
Frutarom
isoPROPYL HEXANOATE
Grau Aromatics
iso-PROPYL-CAPROATE (iso-PROPYLHEXANOATE)
NI, Kosher
Inoue Perfumery
isoPROPYL HEXANOATE
Lluch Essence
isoPROPYL CAPROATE 98%
Odor: FRUITY, BERRY, SWEET
Penta International
ISOPROPYL CAPROATE, Kosher
Santa Cruz Biotechnology
For experimental / research use only.
isoPropyl Hexanoate
SRS Aromatics
isoPROPYL CAPROATE
TCI AMERICA
For experimental / research use only.
isoPropyl Hexanoate >98.0%(GC)
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Safety Information:
Preferred SDS: View
European information :
Most important hazard(s):
Xi - Irritant
R 10 - Flammable.
R 36/37/38 - Irritating to eyes, respiratory system, and skin.
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
Synonyms   Articles   Notes   Search   Top
Safety in Use Information:
Category: flavor and fragrance agents
Recommendation for isopropyl hexanoate usage levels up to:
  5.0000 % in the fragrance concentrate.
 
Maximised Survey-derived Daily Intakes (MSDI-EU): 3.20 (μg/capita/day)
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: 3
Click here to view publication 3
 average usual ppmaverage maximum ppm
baked goods: 20.0000040.00000
beverages(nonalcoholic): -0.50000
beverages(alcoholic): --
breakfast cereal: --
cheese: --
chewing gum: --
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: 5.5000010.00000
fruit ices: 5.5000010.00000
gelatins / puddings: --
granulated sugar: --
gravies: --
hard candy: 20.0000040.00000
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):
Opinion of the Scientific Panel on food additives, flavourings, processing aids and materials in contact with food (AFC) related to Flavouring Group Evaluation 7 (FGE.07): Saturated and unsaturated aliphatic secondary alcohols, ketones and esters of secondary alcohols and saturated linear or branched-chain carboxylic acids from chemical group 5
View page or View pdf
Flavouring Group Evaluation 7, Revision 1 (FGE.07Rev1): Saturated and unsaturated aliphatic secondary alcohols, ketones and esters of secondary alcohols and saturated linear or branched-chain carboxylic acids from chemical group 5 (Commission Regulation (EC) No 1565/2000 of 18 July 2000) - Scientific opinion of the Panel on Food Additives, Flavourings, Processing Aids and Materials in contact with Food (AFC) on a request from the Commission
View page or View pdf
Flavouring Group Evaluation 7, Revision 2 (FGE.07Rev2) : Saturated and unsaturated aliphatic secondary alcohols, ketones and esters of secondary alcohols and saturated linear or branched-chain carboxylic acids from chemical group 5
View page or View pdf
EPI System: View
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 16832
National Institute of Allergy and Infectious Diseases: Data
WGK Germany: 3
 propan-2-yl hexanoate
Chemidplus: 0002311468
Synonyms   Articles   Notes   Search   Top
References:
 propan-2-yl hexanoate
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 2311-46-8
Pubchem (cid): 16832
Pubchem (sid): 134982702
Flavornet: 2311-46-8
Pherobase: View
Synonyms   Articles   Notes   Search   Top
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 Everything Added to Food in the United States (EAFUS): View
HMDB (The Human Metabolome Database): HMDB40430
FooDB: FDB020163
Export Tariff Code: 2915.90.5050
VCF-Online: VCF Volatile Compounds in Food
ChemSpider: View
Read: Under the conditions of intended use - New developments in the FEMA GRAS program and the safety assessment of flavor ingredients
Read: A GRAS assessment program for flavor ingredients
Read: Sensory testing for flavorings with modifying properties. Food Technology
Read: Criteria for the safety evaluation of flavoring substances
Read: A procedure for the safety evaluation of natural flavor complexes used as ingredients in food: essential oils
Read: FEMA Expert Panel: 30 Years of safety evaluation for the flavor industry
Read: Consumption ratio and food predominance of flavoring materials
Synonyms   Articles   Notes   Search   Top
Potential Blenders and core components note
 
For Odor
No odor group found for these
(E)-5-nonen-2-oneFL/FR
alliaceous
 methyl furfuryl disulfideFL/FR
amber
 ambrette seed absoluteFL/FR
animal
 methyl (E)-2-octenoateFL/FR
caramellic
 maltyl isobutyrateFL/FR
chemical
 propyl propionateFL/FR
ethereal
 propyl formateFL/FR
fatty
 allyl octanoateFL/FR
 methyl 2-hexenoateFL/FR
fermented
 valeraldehydeFL/FR
floral
alpha-damasconeFL/FR
beta-iononeFL/FR
 nerolin fragarolFL/FR
 rose carboxylateFR
fruity
 allyl 10-undecenoateFL/FR
 allyl 3,5,5-trimethyl hexanoateFL/FR
 allyl cinnamateFL/FR
 allyl cyclohexyl acetateFL/FR
 allyl cyclohexyl butyrateFL/FR
 allyl cyclohexyl propionateFL/FR
 allyl heptanoateFL/FR
 allyl hexanoateFL/FR
 allyl sorbateFL/FR
(E,E)-allyl sorbateFL/FR
 amyl hexanoateFL/FR
 amyl propionateFL/FR
 benzyl butyrateFL/FR
 benzyl ethyl etherFL/FR
3-benzyl-4-heptanoneFL/FR
 berry hexanoateFR
isobutyl 2-butenoateFL/FR
 butyl butyrateFL/FR
isobutyl butyrateFL/FR
 butyl hexanoateFL/FR
isobutyl hexanoateFL/FR
isobutyl isobutyrateFL/FR
 butyl isovalerateFL/FR
 butyl valerateFL/FR
 cinnamyl isobutyrateFL/FR
 cyclohexyl hexanoateFL/FR
 ethyl (Z)-4-octenoateFL/FR
 ethyl 2-hydroxy-3-methyl valerateFL/FR
 ethyl 3-(2-furyl) propanoateFL/FR
 ethyl 3-hexenoateFL/FR
 ethyl 3-methyl valerateFL/FR
 ethyl butyrateFL/FR
 ethyl cyclohexane propionateFL/FR
 ethyl heptanoateFL/FR
 ethyl hexanoateFL/FR
 ethyl methyl-para-tolyl glycidateFL/FR
 heliotropyl isobutyrateFL/FR
beta-ionone epoxideFL/FR
 methyl (Z)-4-octenoateFL/FR
 methyl 2-methyl valerateFL/FR
 methyl hexanoateFL/FR
 methyl isovalerateFL/FR
3-nonen-2-oneFL/FR
 osmanthus flower absoluteFL/FR
 pineapple hydroxyhexanoateFL/FR
isopropenyl acetateFL/FR
isopropyl isobutyrateFL/FR
isopropyl isovalerateFL/FR
 styralyl butyrateFL/FR
 vanilla carboxylateFL/FR
 galbanum oxyacetateFR
 galbascone (IFF)FR
(Z)-3-hexen-1-yl 2-methyl butyrateFL/FR
3-hexenyl 2-methyl butyrateFL/FR
 pineapple heptadienone 10%FR
 thiogeraniolFL/FR
mentholic
 menthyl acetate racemicFL/FR
soapy
 ambrettolideFL/FR
sulfurous
 blackberry thiophenoneFL/FR
 buchu mercaptanFL/FR
 ethyl methyl mercaptopropionateFL/FR
tropical
 tropical 3-thiobutyrateFL/FR
waxy
(E)-2-octen-1-yl butyrateFL/FR
 
For Flavor
 
No flavor group found for these
 allyl 10-undecenoateFL/FR
 allyl 3,5,5-trimethyl hexanoateFL/FR
 allyl cinnamateFL/FR
 allyl cyclohexyl butyrateFL/FR
(E,E)-allyl sorbateFL/FR
 allyl sorbateFL/FR
 allyl tiglateFL
isoamyl 3-methyl thiopropionateFL
 amyl propionateFL/FR
 benzyl ethyl etherFL/FR
 blackberry thiophenoneFL/FR
 cyclohexyl hexanoateFL/FR
 ethyl 2-hydroxy-3-methyl valerateFL/FR
 ethyl 3-methyl valerateFL/FR
 ethyl cyclohexane propionateFL/FR
 heliotropyl isobutyrateFL/FR
beta-ionone epoxideFL/FR
 menthyl acetate racemicFL/FR
 methyl (Z)-4-octenoateFL/FR
 methyl 2-hexenoateFL/FR
(E)-5-nonen-2-oneFL/FR
(E)-2-octen-1-yl butyrateFL/FR
(E)-2-octen-4-olFL
 osmanthus flower absoluteFL/FR
isopropyl isobutyrateFL/FR
isopropyl isovalerateFL/FR
 sorbyl propionateFL
caramellic
 maltyl isobutyrateFL/FR
coffee
 methyl furfuryl disulfideFL/FR
ethereal
isopropenyl acetateFL/FR
fatty
 allyl octanoateFL/FR
fruity
 allyl cyclohexyl acetateFL/FR
 allyl cyclohexyl propionateFL/FR
 allyl heptanoateFL/FR
 allyl hexanoateFL/FR
 amyl hexanoateFL/FR
 benzyl butyrateFL/FR
3-benzyl-4-heptanoneFL/FR
 butyl butyrateFL/FR
isobutyl butyrateFL/FR
isobutyl hexanoateFL/FR
 butyl hexanoateFL/FR
isobutyl isobutyrateFL/FR
 butyl isovalerateFL/FR
 butyl valerateFL/FR
 cinnamyl isobutyrateFL/FR
alpha-damasconeFL/FR
 ethyl (Z)-4-octenoateFL/FR
 ethyl 3-(2-furyl) propanoateFL/FR
 ethyl 3-hexenoateFL/FR
 ethyl 3-oxohexanoateFL
 ethyl butyrateFL/FR
 ethyl heptanoateFL/FR
 ethyl hexanoateFL/FR
 ethyl methyl-para-tolyl glycidateFL/FR
 furfuryl isovalerateFL
 furfuryl valerateFL
 methyl (E)-2-octenoateFL/FR
 methyl 2-methyl valerateFL/FR
 methyl hexanoateFL/FR
 methyl isovalerateFL/FR
 nerolin fragarolFL/FR
 pineapple hydroxyhexanoateFL/FR
 propyl formateFL/FR
 styralyl butyrateFL/FR
 vanilla carboxylateFL/FR
green
isobutyl 2-butenoateFL/FR
(Z)-3-hexen-1-yl 2-methyl butyrateFL/FR
3-hexenyl 2-methyl butyrateFL/FR
minty
 thiogeraniolFL/FR
oily
3-nonen-2-oneFL/FR
soapy
 ambrettolideFL/FR
sulfurous
 buchu mercaptanFL/FR
 ethyl methyl mercaptopropionateFL/FR
 methyl 4-(methyl thio) butyrateFL
 tropical 3-thiobutyrateFL/FR
tropical
 propyl propionateFL/FR
winey
 valeraldehydeFL/FR
woody
 ambrette seed absoluteFL/FR
beta-iononeFL/FR
 
Synonyms   Articles   Notes   Search   Top
Potential Uses:
 appleFR
 bananaFR
 berryFR
 cheese blueFL
Synonyms   Articles   Notes   Search   Top
Occurrence (nature, food, other): note
 cheese bleu cheese
Search  Picture
 cheese gruyere cheese
Search  Picture
 cheese parmesan cheese
Search  Picture
 grape
Search  Picture
 heracleum paphlagonicum czeczott fruit oil turkey @ <0.01%
Data  GC  Search Trop  Picture
 star fruit fruit
Search Trop  Picture
 strawberry wild strawberry fruit
Search Trop  Picture
 wood smoke
Search  Picture
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Synonyms:
 caproic acid isopropyl ester
 hexanoic acid 1-methyl ethyl ester
 hexanoic acid 1-methylethyl ester
 hexanoic acid isopropyl ester
 hexanoic acid, 1-methylethyl ester
 hexanoic acid, isopropyl ester
1-methyl ethyl hexanoate
1-methylethyl hexanoate
 propan-2-yl hexanoate
isopropyl caproate
isopropyl capronate
isopropyl hexylate
iso-propyl-caproate (iso-propylhexanoate)
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Synonyms   Articles   Notes   Search   Top
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