ethyl 5-hydroxyoctanoate
octanoic acid, 5-hydroxy-, ethyl ester
 
Notes:
None found
  • BOC Sciences
    • BOC Sciences
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      Product(s):
      75587-05-2 Ethyl 5-hydroxyoctanoate
       
  • CSA
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Fragrance Demo Formulas
CAS Number: 75587-05-2Picture of molecule3D/inchi
% from: 21.00% to 24.00%
FDA UNII: DM8A2QF55Y
Nikkaji Web: J140.304D
XlogP3-AA: 1.80 (est)
Molecular Weight: 188.26700000
Formula: C10 H20 O3
NMR Predictor: Predict (works with chrome or firefox)
EFSA/JECFA Comments: JECFA: SC: 5-6% Ethanol; 17-18% 1,5-Octanolide; 21-24% 5-Hydroxydecanoic acid and Ethyl- 5 hydroxyoctanoate ester
Category: flavoring agents
 
US / EU / FDA / JECFA / FEMA / FLAVIS / Scholar / Patent Information:
Google Scholar: Search
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Perfumer and Flavorist: Search
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PubMed: Search
NCBI: Search
JECFA Food Flavoring: 1987  ethyl 5-hydroxyoctanoate
FEMA Number: 4610 ethyl 5-hydroxyoctanoate
FDA:No longer provide for the use of these seven synthetic flavoring substances
FDA Mainterm (SATF):75587-05-2 ; ETHYL 5-HYDROXYOCTANOATE
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Physical Properties:
Appearance: colorless to pale yellow clear liquid (est)
Assay: 50.00 to 100.00 % 
Food Chemicals Codex Listed: No
Specific Gravity: 0.96000 to 0.97000 @  20.00 °C.
Pounds per Gallon - (est).: 7.997 to  8.081
Refractive Index: 1.43800 to 1.44800 @  20.00 °C.
Boiling Point: 252.00 to  254.00 °C. @ 760.00 mm Hg
Vapor Pressure: 0.003000 mmHg @ 25.00 °C. (est)
Flash Point: 201.00 °F. TCC ( 93.89 °C. )
logP (o/w): 1.969 (est)
Soluble in:
 alcohol
 water, 1860 mg/L @ 25 °C (est)
Insoluble in:
 water
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Organoleptic Properties:
 
Odor Type: fruity
 
 sweet  fatty  pineapple  fruity  
Odor Description:
at 100.00 %. 
sweet fatty pineapple fruity
 
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 5-hydroxyoctanoate
Inoue Perfumery
ETHYL 5-HYDROXYOCTANOATE
Chemical Sources Association
Need This Item for Flavor/Food?: You can contact the CSA
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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
IFRA Code of Practice Notification of the 49th Amendment to the IFRA Code of Practice
 
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): 3.0000040.00000
beverages(alcoholic): 3.0000040.00000
breakfast cereal: --
cheese: --
chewing gum: 6.0000060.00000
condiments / relishes: --
confectionery froastings: 5.0000060.00000
egg products: --
fats / oils: --
fish products: --
frozen dairy: --
fruit ices: 5.0000050.00000
gelatins / puddings: 5.0000040.00000
granulated sugar: --
gravies: --
hard candy: 5.0000050.00000
imitation dairy: --
instant coffee / tea: --
jams / jellies: 6.0000050.00000
meat products: --
milk products: --
nut products: --
other grains: --
poultry: --
processed fruits: --
processed vegetables: --
reconstituted vegetables: --
seasonings / flavors: --
snack foods: --
soft candy: 7.00000100.00000
soups: --
sugar substitutes: --
sweet sauces: --
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Safety References:
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 : 6432923
National Institute of Allergy and Infectious Diseases: Data
 ethyl 5-hydroxyoctanoate
Chemidplus: 0075587052
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References:
 ethyl 5-hydroxyoctanoate
NIST Chemistry WebBook: Search Inchi
Canada Domestic Sub. List: 75587-05-2
Pubchem (cid): 6432923
Pubchem (sid): 135211763
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): Search
VCF-Online: VCF Volatile Compounds in Food
ChemSpider: View
FAO: Ethyl 5-hydroxyoctanoate
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Potential Blenders and core components note
 
For Odor
aldehydic
isovaleraldehydeFL/FR
animal
 methyl (E)-2-octenoateFL/FR
caramellic
 maltyl propionateFL/FR
 heptanoic acidFL/FR
chemical
 propyl propionateFL/FR
coconut
delta-undecalactoneFL/FR
creamy
gamma-butyrolactoneFL/FR
ethereal
 decyl propionateFL/FR
 propyl valerateFL/FR
fatty
 allyl decanoateFL/FR
 allyl octanoateFL/FR
isobutyl undecylenateFL/FR
 coconut absoluteFL/FR
(R)-gamma-decalactoneFL/FR
(S)-gamma-decalactoneFL/FR
 dodecyl butyrateFL/FR
 ethyl undecylenateFL/FR
 methyl 2-hexenoateFL/FR
(Z)-2-octenal 
floral
 geranyl valerateFL/FR
 phenethyl hexanoateFL/FR
2-phenyl propyl isobutyrateFL/FR
fruity
 allyl 10-undecenoateFL/FR
 allyl 3,5,5-trimethyl hexanoateFL/FR
 allyl butyrateFL/FR
 allyl cinnamateFL/FR
 allyl cyclohexyl acetateFL/FR
 allyl cyclohexyl butyrateFL/FR
 allyl cyclohexyl propionateFL/FR
 allyl heptanoateFL/FR
 allyl hexanoateFL/FR
 allyl isovalerateFL/FR
 allyl phenoxyacetateFL/FR
 allyl sorbateFL/FR
 amyl butyrateFL/FR
 amyl hexanoateFL/FR
isoamyl hexanoateFL/FR
isoamyl isobutyrateFL/FR
isoamyl octanoateFL/FR
isoamyl propionateFL/FR
 amyl propionateFL/FR
 benzyl ethyl etherFL/FR
 benzyl isovalerateFL/FR
isobutyl (E)-2-butenoate 
isobutyl 2-butenoateFL/FR
isobutyl butyrateFL/FR
 butyl butyrateFL/FR
isobutyl furyl propionateFL/FR
isobutyl hexanoateFL/FR
 butyl hexanoateFL/FR
 butyl isobutyrateFL/FR
isobutyl isobutyrateFL/FR
 butyl isovalerateFL/FR
 butyl valerateFL/FR
 cherry pentenoateFL/FR
 cinnamyl isobutyrateFL/FR
 cyclohexyl butyrateFL/FR
 cyclohexyl hexanoateFL/FR
(S)-gamma-dodecalactoneFL/FR
 ethyl (Z)-4-octenoateFL/FR
 ethyl 3-(2-furyl) propanoateFL/FR
 ethyl 3-hexenoateFL/FR
 ethyl 3-hydroxyhexanoateFL/FR
 ethyl 3-methyl valerateFL/FR
 ethyl butyrateFL/FR
 ethyl cyclohexane propionateFL/FR
 ethyl heptanoateFL/FR
 ethyl hexanoateFL/FR
 ethyl isovalerateFL/FR
 ethyl levulinateFL/FR
 ethyl propionateFL/FR
 ethyl valerateFL/FR
 ethyl-2-cyclopentenyl acetateFR
 geranyl isovalerateFL/FR
4-heptanoneFL/FR
 linalyl hexanoateFL/FR
 methyl (Z)-4-octenoateFL/FR
 methyl 3-nonenoateFL/FR
 methyl 4-methyl valerateFL/FR
 methyl butyrateFL/FR
 methyl hexanoateFL/FR
 methyl isobutyrateFL/FR
 methyl isovalerateFL/FR
 methyl valerateFL/FR
 octyl heptanoateFL/FR
 pineapple hydroxyhexanoateFL/FR
 pineapple pentenoateFL/FR
isopropyl 2-methyl butyrateFL/FR
isopropyl butyrateFL/FR
 propyl butyrateFL/FR
 propyl heptanoateFL/FR
isopropyl hexanoateFL/FR
 propyl hexanoateFL/FR
isopropyl isobutyrateFL/FR
isopropyl isovalerateFL/FR
isopropyl propionateFL/FR
isopropyl valerateFL/FR
 tetrahydrofurfuryl butyrateFL/FR
 tropical iononeFL/FR
2-undecanoneFL/FR
 vanilla carboxylateFL/FR
green
beta-bisabolenal 
 cognac heptanoneFL/FR
 ethyl (E)-4-decenoateFL/FR
 galbanum oxyacetateFR
(E)-2-hexen-1-yl valerateFL/FR
3-hexenyl 2-methyl butyrateFL/FR
 manzanate (Givaudan)FL/FR
 methyl (E)-3-hexenoateFL/FR
 pineapple heptadienone 10%FR
 sorbyl isobutyrateFL/FR
 spirogalbanone (Givaudan)FR
herbal
 benzyl octanoateFL/FR
 herbal undecanoneFR
nutty
2-methyl-3-ethoxypyrazineFL/FR
oily
 glyceryl tripropanoate 
sulfurous
 ethyl methyl mercaptopropionateFL/FR
O-methyl S-1-methoxyhexan-3-yl carbonothioateFL/FR
tropical
 pina colada fragranceFR
 tropical 3-thiobutyrateFL/FR
2-tropical oxathianeFL/FR
waxy
 allyl nonanoateFL/FR
(Z)-4-decen-1-olFL/FR
 ethyl octanoateFL/FR
 heptyl octanoateFL/FR
 methyl undecanoateFR
 propyl decanoateFL/FR
winey
2-hexanolFL/FR
 
For Flavor
 
No flavor group found for these
 acetoneFL
 allyl 10-undecenoateFL/FR
 allyl 3,5,5-trimethyl hexanoateFL/FR
 allyl cinnamateFL/FR
 allyl cyclohexyl butyrateFL/FR
 allyl cyclohexyl valerateFL
 allyl sorbateFL/FR
isoamyl 3-methyl thiopropionateFL
 amyl propionateFL/FR
 benzyl ethyl etherFL/FR
 benzyl octanoateFL/FR
beta-bisabolenal 
isobutyl undecylenateFL/FR
 cocos nucifera waterFL
 cyclohexyl butyrateFL/FR
 cyclohexyl hexanoateFL/FR
(R)-gamma-decalactoneFL/FR
(S)-gamma-decalactoneFL/FR
(Z)-4-decen-1-olFL/FR
9-decen-2-oneFL
 decyl propionateFL/FR
(S)-gamma-dodecalactoneFL/FR
 dodecyl butyrateFL/FR
2,3-epoxyoctanalFL
 ethyl (E)-3-octenoateFL
 ethyl 3-methyl valerateFL/FR
 ethyl cyclohexane propionateFL/FR
 ethyl cyclohexyl carboxylateFL
 geranyl valerateFL/FR
2-hexanolFL/FR
 linalyl hexanoateFL/FR
 methyl (Z)-4-octenoateFL/FR
 methyl 2-hexenoateFL/FR
4-methyl-2-pentenoic acidFL
2-methyl-3-ethoxypyrazineFL/FR
3,5-octadien-2-oneFL
(Z)-2-octenal 
 octyl heptanoateFL/FR
 oenanthic etherFL
2-phenyl propyl isobutyrateFL/FR
 propyl decanoateFL/FR
isopropyl hexanoateFL/FR
isopropyl isobutyrateFL/FR
isopropyl isovalerateFL/FR
 propyl valerateFL/FR
isopropyl valerateFL/FR
 sorbyl propionateFL
3,5-undecadien-2-oneFL
isobutyl furyl propionateFL/FR
 sorbyl isobutyrateFL/FR
acidic
(E)-2-hexenoic acidFL
caramellic
 maltyl propionateFL/FR
citrus
 cognac heptanoneFL/FR
cooling
 manzanate (Givaudan)FL/FR
creamy
delta-undecalactoneFL/FR
ethereal
 methyl isobutyrateFL/FR
fatty
 allyl octanoateFL/FR
 coconut absoluteFL/FR
 ethyl (E)-4-decenoateFL/FR
 ethyl undecylenateFL/FR
2-pentyl thiopheneFL
2,4-undecadienalFL
floral
 tropical iononeFL/FR
fruity
 allyl cyclohexyl acetateFL/FR
 allyl cyclohexyl propionateFL/FR
 allyl decanoateFL/FR
 allyl heptanoateFL/FR
 allyl hexanoateFL/FR
 allyl isovalerateFL/FR
 allyl phenoxyacetateFL/FR
 amyl butyrateFL/FR
isoamyl hexanoateFL/FR
 amyl hexanoateFL/FR
isoamyl isobutyrateFL/FR
isoamyl octanoateFL/FR
isoamyl propionateFL/FR
 benzyl isovalerateFL/FR
isobutyl butyrateFL/FR
 butyl butyrateFL/FR
isobutyl hexanoateFL/FR
 butyl hexanoateFL/FR
isobutyl isobutyrateFL/FR
 butyl isobutyrateFL/FR
 butyl isovalerateFL/FR
 butyl valerateFL/FR
 cherry pentenoateFL/FR
 cinnamyl isobutyrateFL/FR
 ethyl (E)-2-octenoateFL
 ethyl (Z)-4-octenoateFL/FR
 ethyl 3-(2-furyl) propanoateFL/FR
 ethyl 3-hexenoateFL/FR
 ethyl 3-hydroxyhexanoateFL/FR
 ethyl butyrateFL/FR
 ethyl heptanoateFL/FR
 ethyl hexanoateFL/FR
 ethyl isovalerateFL/FR
 ethyl levulinateFL/FR
 ethyl propionateFL/FR
 ethyl valerateFL/FR
 furfuryl valerateFL
4-heptanoneFL/FR
 methionyl butyrateFL
 methyl (E)-2-octenoateFL/FR
 methyl (E)-3-nonenoateFL
 methyl 3-nonenoateFL/FR
 methyl 4-methyl valerateFL/FR
 methyl hexanoateFL/FR
 methyl isovalerateFL/FR
(methyl thio) methyl hexanoateFL
 methyl valerateFL/FR
 pineapple hydroxyhexanoateFL/FR
 pineapple pentenoateFL/FR
isopropyl 2-methyl butyrateFL/FR
isopropyl butyrateFL/FR
 propyl butyrateFL/FR
 propyl hexanoateFL/FR
isopropyl propionateFL/FR
 tetrahydrofurfuryl butyrateFL/FR
isovaleraldehydeFL/FR
 vanilla carboxylateFL/FR
fusel
 methyl butyrateFL/FR
green
 allyl butyrateFL/FR
isobutyl 2-butenoateFL/FR
 geranyl isovalerateFL/FR
(E)-2-hexen-1-yl valerateFL/FR
3-hexenyl 2-methyl butyrateFL/FR
 methyl (E)-3-hexenoateFL/FR
3-(5-methyl-2-furyl) butanalFL
milky
gamma-butyrolactoneFL/FR
oily
 glyceryl tripropanoate 
roasted
O-methyl S-1-methoxyhexan-3-yl carbonothioateFL/FR
sulfurous
 ethyl methyl mercaptopropionateFL/FR
 methyl 4-(methyl thio) butyrateFL
 tropical 3-thiobutyrateFL/FR
tropical
 propyl propionateFL/FR
2-tropical oxathianeFL/FR
waxy
 allyl nonanoateFL/FR
isobutyl (E)-2-butenoate 
 ethyl octanoateFL/FR
 heptanoic acidFL/FR
 heptyl octanoateFL/FR
 phenethyl hexanoateFL/FR
 propyl heptanoateFL/FR
2-undecanoneFL/FR
 
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Potential Uses:
 bramble arctic bramble blackberryFR
 citrusFR
 coconut tropical coconutFR
 fruitFR
 jackfruitFL
 pineappleFR
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Occurrence (nature, food, other): note
 coconut roasted coconut
Search Trop  Picture
 gooseberry cape gooseberry fruit
Search Trop  Picture
 pineapple fruit
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 raspberry red raspberry fruit
Search Trop  Picture
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Synonyms:
5-hydroxyoctanoic acid ethyl ester
 octanoic acid, 5-hydroxy-, ethyl ester
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