ethyl 3-hydroxyoctanoate
3-hydroxyoctanoic acid ethyl ester
 
Notes:
Isol. from various fruits; Flavouring agent [CCD]
  • BOC Sciences
    • BOC Sciences
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      Product(s):
      7367-90-0 Ethyl 3-hydroxyoctanoate
       
  • M&U International
    • M&U International LLC
      Steady supply & demand
      Meeting customers increasing demands at home as well as abroad.
      M&U dedicates itself to the development and production of new products as well as continuously promoting those new products. We’ve maintained a steady supply&demand relationship with a large number of manufacturers at home and abroad. We’ve developed an extensive network and because of our relationships with these manufacturers, we’re able to provide a stable supply of great quality materials. We’re located in China’s largest communications hub, Shanghai and in the U.S. near one of the largest sea ports on the East Coast. The strategic locations of our facilities ensure convenient, prompt and secure delivery of our products to our customers.
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      News
      Product(s):
      A0359 ETHYL 3-HYDROXYOCTANOATE, Kosher
       
  • 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.
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      Product(s):
      05-41300 ETHYL-3-HYDROXY OCTANOATE
       
Synonyms   Articles   Notes   Search
CAS Number: 7367-90-0Picture of molecule3D/inchi
ECHA EINECS - REACH Pre-Reg: 230-919-4
FDA UNII: 6RC31Z1JXT
Nikkaji Web: J140.302H
MDL: MFCD00082952
CoE Number: 10603
XlogP3-AA: 2.10 (est)
Molecular Weight: 188.26700000
Formula: C10 H20 O3
NMR Predictor: Predict (works with chrome or firefox)
EFSA/JECFA Comments: Racemate (EFFA, 2010a).
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
JECFA Food Flavoring: 1955  ethyl 3-hydroxyoctanoate
DG SANTE Food Flavourings: 09.916  ethyl 3-hydroxyoctanoate
FEMA Number: 4453 ethyl 3-hydroxyoctanoate
FDA:No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF):7367-90-0 ; ETHYL 3-HYDROXYOCTANOATE
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Physical Properties:
Appearance: colorless clear liquid (est)
Assay: 95.00 to 100.00 % 
Food Chemicals Codex Listed: No
Specific Gravity: 0.97300 to 0.97900 @  25.00 °C.
Pounds per Gallon - (est).: 8.096 to  8.146
Refractive Index: 1.42100 to 1.42700 @  20.00 °C.
Boiling Point: 275.00 to  276.00 °C. @ 760.00 mm Hg
Vapor Pressure: 0.001000 mmHg @ 25.00 °C. (est)
Flash Point: 228.00 °F. TCC ( 108.89 °C. )
logP (o/w): 2.136 (est)
Soluble in:
 alcohol
 water, 1860 mg/L @ 25 °C (est)
Insoluble in:
 water
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Organoleptic Properties:
 
Odor Type: winey
 
 winey  fruity  floral  
Odor Description:
at 100.00 %. 
winey fruity floral
 
Odor and/or flavor descriptions from others (if found).
 
 
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Cosmetic Information:
None found
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Suppliers:
BOC Sciences
For experimental / research use only.
Ethyl 3-hydroxyoctanoate
M&U International
ETHYL 3-HYDROXYOCTANOATE, Kosher
Matrix Scientific
For experimental / research use only.
Ethyl 3-hydroxyoctanoate, 95+%
Penta International
ETHYL-3-HYDROXY OCTANOATE
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Safety Information:
 
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 ethyl 3-hydroxyoctanoate usage levels up to:
 not for fragrance use.
 
Maximised Survey-derived Daily Intakes (MSDI-EU): 0.011 (μg/capita/day)
Modified Theoretical Added Maximum Daily Intake (mTAMDI): 3900 (μg/person/day)
Threshold of Concern:1800 (μg/person/day)
Structure Class: I
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: 24
Click here to view publication 24
 average usual ppmaverage maximum ppm
baked goods: --
beverages(nonalcoholic): 0.050000.20000
beverages(alcoholic): 0.000100.00100
breakfast cereal: --
cheese: --
chewing gum: 0.000100.00100
condiments / relishes: --
confectionery froastings: --
egg products: --
fats / oils: --
fish products: --
frozen dairy: --
fruit ices: --
gelatins / puddings: 0.200002.00000
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: --
 
Food categories according to Commission Regulation EC No. 1565/2000 (EC, 2000) in FGE.06 (EFSA, 2002a). According to the Industry the "normal" use is defined as the average of reported usages and "maximum use" is defined as the 95th percentile of reported usages (EFSA, 2002i).
Note: mg/kg = 0.001/1000 = 0.000001 = 1/1000000 = ppm.
 average usage mg/kgmaximum usage mg/kg
Dairy products, excluding products of category 02.0 (01.0): 7.0000035.00000
Fats and oils, and fat emulsions (type water-in-oil) (02.0): 5.0000025.00000
Edible ices, including sherbet and sorbet (03.0): 10.0000050.00000
Processed fruit (04.1): 7.0000035.00000
Processed vegetables (incl. mushrooms & fungi, roots & tubers, pulses and legumes), and nuts & seeds (04.2): --
Confectionery (05.0): 10.0000050.00000
Chewing gum (05.0): --
Cereals and cereal products, incl. flours & starches from roots & tubers, pulses & legumes, excluding bakery (06.0): 5.0000025.00000
Bakery wares (07.0): 10.0000050.00000
Meat and meat products, including poultry and game (08.0): 2.0000010.00000
Fish and fish products, including molluscs, crustaceans and echinoderms (MCE) (09.0): 2.0000010.00000
Eggs and egg products (10.0): --
Sweeteners, including honey (11.0): --
Salts, spices, soups, sauces, salads, protein products, etc. (12.0): 5.0000025.00000
Foodstuffs intended for particular nutritional uses (13.0): 10.0000050.00000
Non-alcoholic ("soft") beverages, excl. dairy products (14.1): 5.0000025.00000
Alcoholic beverages, incl. alcohol-free and low-alcoholic counterparts (14.2): 10.0000050.00000
Ready-to-eat savouries (15.0): 20.00000100.00000
Composite foods (e.g. casseroles, meat pies, mincemeat) - foods that could not be placed in categories 01.0 - 15.0 (16.0): 5.0000025.00000
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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 10, Revision 1 (FGE10 Rev1)[1] - Aliphatic primary and secondary saturated and unsaturated alcohols, aldehydes, acetals, carboxylic acids and esters containing an additional oxygenated functional group and lactones from chemical groups 9, 13 and 30 - Scientific Opinion of the Panel on Food Additives, Flavourings, Processing Aids and Materials in Contact with Food (AFC)
View page or View pdf
Flavouring Group Evaluation 64 (FGE.64): Consideration of aliphatic acyclic diols, triols, and related substances evaluated by JECFA (57th meeting) structurally related to aliphatic primary and secondary saturated and unsaturated alcohols, aldehydes, acetals, carboxylic acids and esters containing an additional oxygenated functional group and lactones from chemical groups 9, 13 and 30 evaluated by EFSA in FGE.10Rev1 (EFSA, 2008ab)
View page or View pdf
Scientific Opinion on Flavouring Group Evaluation 92 (FGE.92): Consideration of aliphatic acyclic diols, triols, and related substances evaluated by JECFA (68th meeting) structurally related to aliphatic primary and secondary saturated and unsaturated alcohols, aldehydes, acetals, carboxylic acids and esters containing an additional oxygenated functional group and lactones evaluated by EFSA in FGE.10Rev1 (2009)
View page or View pdf
Scientific Opinion on Flavouring Group Evaluation 10, Revision 2 (FGE.10Rev2): Aliphatic primary and secondary saturated and unsaturated alcohols, aldehydes, acetals, carboxylic acids and esters containing an additional oxygenated functional group and lactones from chemical groups 9, 13 and 30
View page or View pdf
Scientific Opinion on Flavouring Group Evaluation 10, Revision 3 (FGE.10Rev3): Aliphatic primary and secondary saturated and unsaturated alcohols, aldehydes, acetals, carboxylic acids and esters containing an additional oxygenated functional group and lactones from chemical groups 9, 13 and 30
View page or View pdf
EPI System: View
AIDS Citations: Search
Cancer Citations: Search
Toxicology Citations: Search
EPA ACToR: Toxicology Data
EPA Substance Registry Services (SRS): Registry
Laboratory Chemical Safety Summary : 110975
National Institute of Allergy and Infectious Diseases: Data
 ethyl 3-hydroxyoctanoate
Chemidplus: 0007367900
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References:
 ethyl 3-hydroxyoctanoate
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 7367-90-0
Pubchem (cid): 110975
Pubchem (sid): 135067974
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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): HMDB41600
FooDB: FDB021754
VCF-Online: VCF Volatile Compounds in Food
ChemSpider: View
FAO: Ethyl 3-hydroxyoctanoate
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Potential Blenders and core components note
 
For Odor
balsamic
 cinnamyl butyrateFL/FR
 cinnamyl formateFL/FR
caramellic
 diethyl malateFL/FR
citrus
2-heptanolFL/FR
ethereal
 methyl acetateFL/FR
fatty
 butyl undecylenateFL/FR
fermented
 methyl decanoateFL/FR
isoamyl angelateFL/FR
 benzyl acetateFL/FR
 benzyl acetoacetateFL/FR
 benzyl isobutyrateFL/FR
(S)-citronellyl acetateFL/FR
 citronellyl butyrateFL/FR
 citronellyl hexanoateFL/FR
(E)-citronellyl tiglateFL/FR
 dimethyl benzyl carbinyl acetateFL/FR
 ethyl 2-benzyl butyrateFL/FR
 ethyl anthranilateFL/FR
 ethyl ethyl anthranilateFL/FR
 geraniolFL/FR
 geranyl isobutyrateFL/FR
 ionone mixed isomersFL/FR
isojasmoneFL/FR
 linalyl butyrateFL/FR
 magnolia flower oil CO2 extractFL/FR
 methoxymelonalFL/FR
para-methyl benzyl acetateFL/FR
 methyl benzyl acetate (mixed ortho-,meta-,para-)FL/FR
alpha-isomethyl ionone (90% min.)FL/FR
 methyl ionyl acetateFL/FR
3-nonanon-1-yl acetateFL/FR
 orris rhizome concrete butter (iris pallida)FL/FR
 osmanthus concreteFL/FR
 petitgrain mandarin oilFL/FR
 phenethyl isobutyrateFL/FR
 phenethyl isovalerateFL/FR
1-phenyl propyl butyrateFL/FR
2-phenyl propyl isobutyrateFL/FR
4-phenyl-3-buten-2-olFL/FR
isopropyl benzoateFL/FR
 rhodinyl butyrateFL/FR
 star fruit oil cubaFL/FR
 styralyl propionateFL/FR
 terpinyl valerateFL/FR
fruity
 apricot essenceFL/FR
 benzyl propionateFL/FR
 benzyl valerateFL/FR
 butyl 2-naphthyl etherFL/FR
 butyl anthranilateFL/FR
isobutyl furyl propionateFL/FR
 citronellyl isobutyrateFL/FR
(E)-beta-damasconeFL/FR
(Z)-beta-damasconeFL/FR
beta-damasconeFL/FR
 decanal methyl enol etherFL/FR
 diethyl laevo-tartrateFL/FR
(R)-gamma-dodecalactoneFL/FR
 dodecyl propionateFL/FR
 ethyl 2-ethyl acetoacetateFL/FR
 farnesyl acetoneFL/FR
 geranyl acetoacetateFL/FR
 linalool oxide acetatesFL/FR
3-mercaptohexyl acetateFL/FR
 methyl isobutyrateFL/FR
(E)-7-methyl-3-octen-2-oneFL/FR
(±)-3-methyl-gamma-decalactoneFL/FR
2-nonanone propylene glycol acetalFL/FR
alpha-ocimeneFL/FR
 propyl 2-methyl butyrateFL/FR
 sambucus canadensis fruit absoluteFL/FR
 strawberry glycidate 1 (aldehyde C-16 (so-called))FL/FR
(R)-styralyl acetateFL/FR
4-(para-tolyl)-2-butanoneFL/FR
green
isoamyl 3-(2-furan) propionateFL/FR
green cognac oilFL/FR
herbal
isoamyl tiglateFL/FR
 tagete oil madagascarFL/FR
honey
 methyl hydrocinnamateFL/FR
medicinal
ortho-cresyl acetateFL/FR
mentholic
laevo-menthyl acetateFL/FR
powdery
alpha-methyl iononeFL/FR
(E)-alpha-methyl ionone (74-80%)FL/FR
 spicy acetoacetateFL/FR
waxy
 allyl nonanoateFL/FR
 dihydrocitronellyl acetateFL/FR
(E)-methyl geranateFL/FR
 phytyl acetateFL/FR
winey
 butyl angelateFL/FR
2-hexanolFL/FR
 methyl 3-acetoxyoctanoateFL/FR
woody
 kaempferia galanga rhizome oilFL/FR
 
For Flavor
 
No flavor group found for these
1-acetyl cyclohexyl acetateFL
isoamyl angelateFL/FR
isoamyl tiglateFL/FR
 benzyl valerateFL/FR
 butyl 2-naphthyl etherFL/FR
 butyl angelateFL/FR
2-butyl furanFL
2-butyl thiopheneFL
ortho-cresyl acetateFL/FR
 diethyl laevo-tartrateFL/FR
 diethyl malateFL/FR
 dihydrocitronellyl acetateFL/FR
S-(2,5-dimethyl-3-furyl) ethane thioateFL
(R)-gamma-dodecalactoneFL/FR
 dodecyl propionateFL/FR
 ethyl 2-benzyl butyrateFL/FR
 ethyl ethyl anthranilateFL/FR
 farnesyl acetoneFL/FR
 geranyl acetoacetateFL/FR
2-hexanolFL/FR
4-hydroxyphenethyl alcoholFL
 ionone mixed isomersFL/FR
 linalool oxide acetatesFL/FR
 magnolia flower oil CO2 extractFL/FR
 methyl 3-acetoxyoctanoateFL/FR
 methyl benzyl acetate (mixed ortho-,meta-,para-)FL/FR
(E)-methyl geranateFL/FR
 methyl hydrocinnamateFL/FR
2-nonanone propylene glycol acetalFL/FR
alpha-ocimeneFL/FR
 oenanthic etherFL
1-phenyl propyl butyrateFL/FR
2-phenyl propyl isobutyrateFL/FR
 propyl 2-methyl butyrateFL/FR
isopropyl benzoateFL/FR
(R)-styralyl acetateFL/FR
 vitispiraneFL
isoamyl 3-(2-furan) propionateFL/FR
 benzyl acetoacetateFL/FR
isobutyl furyl propionateFL/FR
beta-damasconeFL/FR
 decanal methyl enol etherFL/FR
burnt
 ethyl 2-furoateFL
camphoreous
 kaempferia galanga rhizome oilFL/FR
citrus
 petitgrain mandarin oilFL/FR
 styralyl propionateFL/FR
ethereal
 methyl acetateFL/FR
 methyl isobutyrateFL/FR
fatty
 methyl decanoateFL/FR
(E)-7-methyl-3-octen-2-oneFL/FR
floral
(S)-citronellyl acetateFL/FR
 citronellyl hexanoateFL/FR
 dimethyl benzyl carbinyl acetateFL/FR
 geraniolFL/FR
 geranyl isobutyrateFL/FR
 linalyl butyrateFL/FR
2-methyl butyl 3-methyl butenoateFL
(E)-alpha-methyl ionone (74-80%)FL/FR
alpha-isomethyl ionone (90% min.)FL/FR
 orris rhizome concrete butter (iris pallida)FL/FR
 rhodinyl butyrateFL/FR
fruity
 apricot essenceFL/FR
 benzyl acetateFL/FR
 benzyl isobutyrateFL/FR
 benzyl propionateFL/FR
 butyl anthranilateFL/FR
 citronellyl butyrateFL/FR
 citronellyl isobutyrateFL/FR
(Z)-beta-damasconeFL/FR
(E)-beta-damasconeFL/FR
 ethyl 2-ethyl acetoacetateFL/FR
 ethyl anthranilateFL/FR
2-heptanolFL/FR
2-hexyl-4-acetoxytetrahydrofuranFL
 methoxymelonalFL/FR
para-methyl benzyl acetateFL/FR
alpha-methyl iononeFL/FR
3-nonanon-1-yl acetateFL/FR
 osmanthus concreteFL/FR
 phenethyl isovalerateFL/FR
 sambucus canadensis fruit absoluteFL/FR
 star fruit oil cubaFL/FR
 strawberry glycidate 1 (aldehyde C-16 (so-called))FL/FR
 tagete oil madagascarFL/FR
 terpinyl valerateFL/FR
4-(para-tolyl)-2-butanoneFL/FR
fusel
green cognac oilFL/FR
green
(E)-citronellyl tiglateFL/FR
isojasmoneFL/FR
honey
 phenethyl isobutyrateFL/FR
minty
laevo-menthyl acetateFL/FR
nutty
 phytyl acetateFL/FR
spicy
 cinnamyl formateFL/FR
 spicy acetoacetateFL/FR
tropical
3-mercaptohexyl acetateFL/FR
waxy
 allyl nonanoateFL/FR
 butyl undecylenateFL/FR
(±)-3-methyl-gamma-decalactoneFL/FR
4-phenyl-3-buten-2-olFL/FR
winey
 cinnamyl butyrateFL/FR
woody
 methyl ionyl acetateFL/FR
 
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Potential Uses:
None Found
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Occurrence (nature, food, other): note
 apple fruit
Search  PMC Picture
 brandy grape brandy
Search  PMC Picture
 gooseberry cape gooseberry fruit
Search Trop  Picture
 grapefruit juice - 0.03 mg/kg
Search Trop  Picture
 orange juice - 0.02 mg/kg
Search Trop  Picture
 papaya fruit - up to 0.05 mg/kg
Search Trop  Picture
 pear fruit
Search Trop  Picture
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Synonyms:
 ethyl-3-hydroxy octanoate
beta-hydroxycaprylic acid ethyl ester
3-hydroxyoctanoic acid ethyl ester
 octanoic acid, 3-hydroxy-, ethyl ester
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