ethyl valerate
Suppliers  organoleptics  properties  safety  references  cosmetics    FEMA Index    Home Page
 
Right Click Jmol Molecule For More Options. (Safari 1.2 (v125) Compatible). Jmol is a free download found Here.
 
IUPAC name :ethyl pentanoate
InChI :InChI=1/C7H14O2/c1-3-5-6-7(8)9-4-2/h3-6H2,1-2H3
InChIKey :ICMAFTSLXCXHRK-UHFFFAOYAC
SMILES :CCCCC(=O)OCC
cas number :539-82-2
(EINECS) number :208-726-1
beilstein number :1744680
fema number :2462
coe number :465
jecfa number :30
fl. number :09.147
molar refractivity :36.25 ± 0.3 cm3
parachor :335.3 ± 4.0 cm3
index of refraction :1.406 ± 0.02
surface tension :26.6 ± 3.0 dyne/cm
density :0.882 ± 0.06 g/cm3
polarizability :14.37 ± 0.5 10-24cm3
XlogP : 2.10
molecular weight : 130.1848600 (IUPAC)
formula :C7 H14 O2
pherobase floral:view
NMR Predictor :Predict
 
 
export tariff code :2915.60.0000
fda reg :172.515
Suppliers :
Cargill :ETHYL VALERATE
natural, Kosher
Odor:  Fruity, Apple
Elan :ethyl valerate
FCC, Kosher
Fontarome :ETHYL N VALERATE
Odor:  Fruity odor suggestive of apple
Grau Aromatics :ETHYL-VALERATE
FCC, NI, Kosher
Hofmen :Ethyl valerate
99%, (naturals)
Inoue :ETHYL VALERATE
Penta :ethyl valerate
SAFC Global® :Ethyl valerate
≥98%, FG, Kosher
Ungerer :Ethyl Valerate
organoleptics :
odor type :fruity
odor strength :high ,
recommend smelling in a 10.00 % solution or less
odor description:
at 10.00 % in dipropylene glycol.  		sweet fruity apple pineapple green tropical
Luebke, William tgsc, (1985)
odor sample from :Fritzsche Dodge & Olcott, Inc.
odor description:
Sweet, fruity, acidic, pineapple, apple, green, berry and tropical
Mosciano, Gerard P&F 23, No. 2, 43, (1998)
taste description:
at 30.00 ppm.  		Fruity, strawberry, sweet, estry, fruity, pineapple and tropical fruit
Mosciano, Gerard P&F 23, No. 2, 43, (1998)
substantivity :4  Hour(s)
properties :
appearence :colorless to pale yellow clear liquid
assay : 98.00 to 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :0.87000 to 0.87500 @ 25.00 °C.
pounds per gallon - calc. : 7.239 to 7.281
refractive index :1.39900 to 1.40400 @ 20.00 °C.
boiling point : 144.00 to 145.00 °C. @ 760.00 mm Hg
boiling point : 72.00 to 74.00 °C. @ 65.00 mm Hg
acid value : 1.00  max.  KOH/g
vapor pressure :4.80000 mm/Hg @ 25.00 °C.
vapor density :4.4 ( Air = 1 )
flash point : 102.00  °F.  TCC  ( 38.89 °C. )
logP (o/w) : 2.34
safety :
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 07/09 - Keep container tightly closed and in well-ventilated place.
S 16 - Keep away from sources of ignition - No Smoking.
S 26 - In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
S 36/37/39 - Wear suitable clothing, gloves and eye/face protection.
Oral Toxicity(LD50) : 
  Not determined
Dermal Toxicity(LD50) : 
  Not determined
Inhalation Toxicity(LC50) : 
  Not determined
 
safety in use :
Category :flavor and fragrance agents
 
recommendation for ethyl valerate fragrance usage levels up to :
  4.0000 % in the fragrance concentrate.
recommendation for ethyl valerate flavor usage levels up to :
  260.0000 ppm in the flavor.
safety references :
EPI System :view
Canada Domestic Sub. List :Yes
EPA Chem. Sub. Inventory : Yes
WISER :UN 3272
 
WGK Germany :3
 
 
 
 
ethyl pentanoate
(EINECS) number :208-726-1
chemidplus :000539822
EPA Substance Registry Services :539-82-2
dtp/nci :8868
references :
 
ethyl pentanoate
fl. number :09.147
jecfa number :30
NIST Chemistry WebBook :1496401821
pubchem :154185
Flavornet :539-82-2
Cosmetics :
Cosmetic uses : perfuming agents
other :
CosIng :cosmetic data
VCF-Online: VCF Volatile Compounds in Food
FDA Everything Added to Food in the United States (EAFUS)View
synonyms :
 ethyl N-valerate
 ethyl pentanoate
 ethyl valerianate
 pentanoic acid ethyl ester
 valeric acid ethyl ester
Similar Products:    note
 allyl valerate
 allyl isovalerate
 amyl valerate
 amyl isovalerate
isoamyl valerate
isoamyl isovalerate
para-anisyl isovalerate
para-anisyl valerate
 benzyl valerate
 benzyl isovalerate
 bornyl valerate
 bornyl isovalerate
(-)-bornyl isovalerate
isobornyl isovalerate
S-sec-butyl thioisovalerate
 butyl valerate
 butyl isovalerate
isobutyl valerate
isobutyl isovalerate
 carvyl isovalerate
 cinnamyl valerate
 cinnamyl isovalerate
 citronellyl valerate
 citronellyl isovalerate
para-cresyl valerate
para-cresyl isovalerate
 cyclohexyl valerate
 cyclohexyl isovalerate
 cyclotene isovalerate
 decyl valerate
 decyl isovalerate
 ethyl isovalerate
 eugenyl isovalerate
 furfuryl isovalerate
 furfuryl valerate
 geranyl valerate
 geranyl isovalerate
(E)-2-hepten-1-yl isovalerate
 heptyl isovalerate
sec-heptyl isovalerate
 heptyl valerate
(E)-2-hexen-1-yl valerate
(E)-2-hexen-1-yl isovalerate
(Z)-3-hexen-1-yl valerate
(Z)-3-hexen-1-yl isovalerate
 hexyl valerate
 hexyl isovalerate
 linalyl valerate
 linalyl isovalerate
 menthyl valerate
 menthyl isovalerate
 methyl 2-methyl valerate
 methyl 4-methyl valerate
2-methyl butyl isovalerate
4-methyl pentyl isovalerate
 methyl thio isovalerate
 methyl valerate
 methyl isovalerate
 myrtenyl isovalerate
 neryl isovalerate
 nonyl isovalerate
 nonyl valerate
 octyl valerate
 octyl isovalerate
 phenethyl isovalerate
2-phenethyl valerate
3-phenyl propyl isovalerate
 phenyl propyl valerate
S-prenyl thioisovalerate
isopropyl thioisovalerate
 propyl valerate
 propyl isovalerate
isopropyl valerate
isopropyl isovalerate
 rhodinyl isovalerate
 terpinyl isovalerate
 terpinyl valerate
soluble in :
 alcohol
 water, 2210 mg/L @ 25C
insoluble in :
 water
potential blenders :    note
 allyl 10-undecenoateFL/FR
 allyl 3,5,5-trimethyl hexanoateFL/FR
 allyl amyl glycolateFR
 allyl butyrateFL/FR
 allyl cinnamateFL/FR
 allyl cyclohexyl acetateFL/FR
 allyl cyclohexyl butyrateFL/FR
 allyl cyclohexyl propionateFL/FR
 allyl cyclohexyl valerateFL
 allyl heptanoateFL/FR
 allyl hexanoateFL/FR
 allyl isovalerateFL/FR
 allyl nonanoateFL/FR
 allyl octanoateFL/FR
 allyl phenoxyacetateFL/FR
 allyl propionateFL/FR
 allyl salicylateFR
 allyl sorbateFL/FR
(E,E)-allyl sorbateFL/FR
 amyl 2-methyl butyrateFL/FR
isoamyl 2-methyl butyrateFL/FR
isoamyl 3-(2-furan) propionateFL/FR
isoamyl 3-methyl thiopropionateFL
 amyl butyrateFL/FR
 amyl hexanoateFL/FR
isoamyl hexanoateFL/FR
 amyl isobutyrateFL/FR
isoamyl isobutyrateFL/FR
 amyl isovalerateFL/FR
isoamyl isovalerateFL/FR
isoamyl octanoateFL/FR
 amyl propionateFL/FR
isoamyl propionateFL/FR
 amyl valerateFL/FR
isoamyl valerateFL/FR
para-anisyl methyl ketoneFL/FR
 apple crotonateFR
 apple ketalFL/FR
 benzyl ethyl etherFL/FR
 benzyl formateFL/FR
 benzyl isovalerateFL/FR
 benzyl methyl tiglateFL
 benzyl octanoateFL/FR
 benzyl propionateFL/FR
 bois de rose oilFL/FR
isobornyl isovalerateFL/FR
isobutyl 2-butenoateFL/FR
isobutyl acetateFL/FR
 butyl butyrateFL/FR
isobutyl butyrateFL/FR
isobutyl furyl propionateFL/FR
 butyl heptanoateFL/FR
 butyl hexanoateFL/FR
isobutyl hexanoateFL/FR
 butyl isobutyrateFL/FR
isobutyl isobutyrateFL/FR
 butyl isovalerateFL/FR
isobutyl isovalerateFL/FR
 butyl valerateFL/FR
 cherry pentenoateFL/FR
 cinnamyl isobutyrateFL/FR
 cinnamyl isovalerateFL/FR
 citronellyl isovalerateFL/FR
 cognac heptanoneFL/FR
 coranolFR
 cubeb oilFL/FR
 cyclohexyl butyrateFL/FR
 cyclohexyl hexanoateFL/FR
 cyclohexyl isovalerateFL/FR
(E)-alpha-damasconeFL/FR
(Z)-alpha-damasconeFL/FR
alpha-damasconeFL/FR
gamma-damasconeFR
3-decen-2-oneFL/FR
 diethyl 1-malateFL
 diethyl malonateFL/FR
 dihydrolinaloolFL/FR
3,6-dimethyl-3-octanolFL/FR
 ethyl (E,Z)-2,4-decadienoateFL/FR
 ethyl (E)-2-decenoateFL/FR
 ethyl (E)-2-octenoateFL
 ethyl (E)-4-decenoateFL/FR
 ethyl (Z)-3-hexenoateFL/FR
 ethyl (Z)-4-octenoateFL/FR
 ethyl 2-methyl butyrateFL/FR
 ethyl 3-(2-furyl) propanoateFL
 ethyl 3-hexenoateFL/FR
 ethyl 3-hydroxyhexanoateFL/FR
 ethyl 3-methyl valerateFL/FR
 ethyl 3,5,5-trimethyl hexanoateFR
 ethyl acetoacetateFL/FR
 ethyl butyrateFL/FR
 ethyl cinnamateFL/FR
 ethyl cyclohexane propionateFL/FR
 ethyl decanoateFL/FR
 ethyl heptanoateFL/FR
 ethyl hexanoateFL/FR
 ethyl levulinateFL/FR
 ethyl linaloolFR
 ethyl linalyl acetalFR
 ethyl linalyl acetateFR
 ethyl linalyl etherFL/FR
 ethyl methyl mercaptopropionateFL/FR
 ethyl propionateFL/FR
 ethyl safranateFR
5-ethyl-2,3,4,5-tetramethyl-2-cyclohexen-1-oneFL/FR
5-ethyl-3,4,5,6-tetramethyl cyclohexen-2-oneFL
 fruity ketalFL/FR
 furfuryl valerateFL
 galbanum ketoneFR
 galbanum oxathianeFL/FR
 galbanum oxyacetateFR
 geranyl acetoacetateFL/FR
 geranyl isovalerateFL/FR
 geranyl methyl ethyl acetateFL/FR
 grape butyrateFL/FR
 green acetateFR
 green apple 
2-heptanoneFL/FR
4-heptanoneFL/FR
 heptyl 2-methyl butyrateFL
 heptyl formateFL/FR
 heptyl isobutyrateFL/FR
 herbal ethanoneFR
 hexanal diethyl acetalFL/FR
(Z)-3-hexen-1-alFL/FR
2-hexen-1-alFL
3-hexen-1-alFL/FR
(E)-2-hexen-1-al diethyl acetalFL
(Z)-3-hexen-1-al diethyl acetalFL/FR
2-hexen-1-al diethyl acetalFL
(E)-2-hexen-1-al dimethyl acetalFL
(Z)-3-hexen-1-al dimethyl acetal 
(Z)-3-hexen-1-yl 2-methyl butyrateFL/FR
3-hexen-1-yl 2-methyl butyrateFL/FR
(E)-2-hexen-1-yl acetateFL/FR
(Z)-3-hexen-1-yl acetateFL/FR
(E)-2-hexen-1-yl butyrateFL/FR
(Z)-3-hexen-1-yl butyrateFL/FR
(Z)-3-hexen-1-yl isobutyrateFL/FR
(E)-2-hexen-1-yl isovalerateFL/FR
(Z)-3-hexen-1-yl isovalerateFL/FR
(Z)-3-hexen-1-yl methyl carbonateFL/FR
(E)-2-hexen-1-yl propionateFL/FR
(Z)-3-hexen-1-yl propionateFL/FR
(E)-2-hexen-1-yl valerateFL
(Z)-3-hexen-1-yl valerateFL/FR
 hexyl 2-butenoateFL/FR
 hexyl 2-furoateFL/FR
 hexyl 2-methyl butyrateFL/FR
 hexyl 3-mercaptobutanoateFL
 hexyl acetateFL/FR
 hexyl butyrateFL/FR
 hexyl formateFL/FR
 hexyl isobutyrateFL/FR
 hexyl octanoateFL/FR
 ho leaf oilFR
 ho wood oilFR
 linaloolFL/FR
dextro-linaloolFL/FR
laevo-linaloolFL/FR
 linalool oxideFL/FR
 linalyl anthranilateFL/FR
 linalyl hexanoateFL/FR
 maltyl propionateFL/FR
 marine formateFR
 melon valerateFL/FR
 methyl (Z)-4-octenoateFL/FR
 methyl 2-hexenoateFL/FR
 methyl 2-methyl butyrateFL/FR
 methyl 2-methyl valerateFL/FR
 methyl 4-(methyl thio) butyrateFL
 methyl 4-methyl valerateFL
2-methyl butyl isovalerateFL/FR
 methyl butyrateFL
 methyl citronellateFL/FR
 methyl heptenoneFL/FR
 methyl hexanoateFL/FR
 methyl isobutyrateFL/FR
 methyl isovalerateFL/FR
 methyl octenoateFL/FR
 methyl propionateFL/FR
 methyl valerateFL/FR
4-methyl-2-penten-1-alFL
2-methyl-3,(5 or 6)-ethoxypyrazineFL
 nonisyl acetateFR
 nonyl isovalerateFL/FR
(Z)-5-octen-1-yl propionateFL/FR
3-octyl acetateFL/FR
 octyl phenyl acetateFL/FR
(E)-2-penten-1-alFL/FR
 phenethyl hexanoateFL/FR
 phenoxyethyl isobutyrateFL/FR
2-phenyl propyl isobutyrateFL/FR
 pineapple heptadienone 10%FR
 pineapple hydroxyhexanoateFL/FR
 pineapple pentenoateFL/FR
isopropyl 2-methyl butyrateFL/FR
 propyl butyrateFL/FR
isopropyl butyrateFL/FR
 propyl heptanoateFL/FR
 propyl hexanoateFL/FR
isopropyl hexanoateFL/FR
isopropyl isobutyrateFL/FR
 propyl isovalerateFL/FR
isopropyl isovalerateFL/FR
 propyl propionateFL/FR
isopropyl propionateFL/FR
 propyl tiglateFL/FR
 sorbyl isobutyrateFL/FR
 sorbyl propionateFL/FR
 tetrahydrofurfuryl butyrateFL/FR
 tetrahydrolinaloolFL/FR
 tolu balsam oilFL/FR
(E)-2-tridecen-1-yl acetateFL/FR
 tropical 3-thiobutyrateFL/FR
 tropical iononeFL/FR
 tropical oxathianeFL/FR
2-undecanoneFL/FR
 vanilla carboxylateFL/FR
potential uses :
 apple
 apricot
 banana
 berry
 cheese
 dairy
 fruit
 fruit tropical fruit
 mint
 pineapple
 rue
 strawberry
 wine
natural occurrence in :    note
 apple  
 apricot S
 cheese parmesan cheese  
 fruits  
 guava fruit S
 mint  
 pineapple  
 rue oil S
 rum  
 strawberry S
data pagetagete flower oil rwanda @ trace% S
 wine red wine  
 wine white wine  

information only - not sold by The Good Scents Company.


Please share your Information / Comments.

Your email Address:


Top of Page          The Good Scents Company Home
Copyright © 1980-2010 The Good Scents Company Disclaimer Privacy Policy
Html Last modified 03/10/2010