propyl formate
Suppliers  organoleptics  properties  safety  references    FEMA Index    Home Page
Notes :
Fruit lifter.
 
Right Click Jmol Molecule For More Options. (Safari 1.2 (v125) Compatible). Jmol is a free download found Here.
 
IUPAC name :propyl formate
InChI :InChI=1/C4H8O2/c1-2-3-6-4-5/h4H,2-3H2,1H3
InChIKey :KFNNIILCVOLYIR-UHFFFAOYAC
SMILES :CCCOC=O
cas number :110-74-7
(EINECS) number :203-798-0
eu annex :607-016-00-2
beilstein number :1739272
fema number :2943
coe number :340
jecfa number :117
fl. number :09.073
molar refractivity :22.51 ± 0.3 cm3
parachor :219.8 ± 4.0 cm3
index of refraction :1.375 ± 0.02
surface tension :25.0 ± 3.0 dyne/cm
density :0.896 ± 0.06 g/cm3
polarizability :8.92 ± 0.5 10-24cm3
XlogP : 0.80
molecular weight : 88.1051200 (IUPAC)
formula :C4 H8 O2
NMR Predictor :Predict
 
 
IUPAC name :propan-1-ol
InChI :InChI=1/C3H8O/c1-2-3-4/h4H,2-3H2,1H3
InChIKey :BDERNNFJNOPAEC-UHFFFAOYAO
SMILES :CCCO
cas number :71-23-8
(EINECS) number :200-746-9
eu annex :603-003-00-0
beilstein number :1098242
fema number :2928
coe number :50
jecfa number :82
fl. number :02.002
molar refractivity :17.48 ± 0.3 cm3
parachor :168.2 ± 4.0 cm3
index of refraction :1.379 ± 0.02
surface tension :24.5 ± 3.0 dyne/cm
density :0.795 ± 0.06 g/cm3
polarizability :6.93 ± 0.5 10-24cm3
XlogP : 0.30
molecular weight : 60.0950200 (IUPAC)
formula :C3 H8 O
BioActivity Analysis :48414931
NMR Predictor :Predict
 
 
export tariff code :2915.13.0000
fda reg :172.515
Suppliers :
Cargill :n-PROPYL FORMATE
natural, Kosher
Odor:  Sweet, Ethereal, Green
Fontarome :PROPYL FORMATE
Odor:  Fruity rum, ethereal
Frutarom :PROPYL FORMATE
≥99.00%, NI, Kosher
Odor:  Alcoholic, Etheral, Fruity, Sweet
Suggested Uses: Apple, Bakery, Cherry, Coffee, Hard Fruits, Plum
Grau Aromatics :PROPYL-FORMATE
NI, Kosher
Inoue :PROPYL FORMATE
Penta :propyl formate
SAFC Global® :Propyl formate
≥97%, Kosher
Odor:  berry; green; ethereal; sweet
organoleptics :
odor type :ethereal
odor strength :medium ,
recommend smelling in a 10.00 % solution or less
odor description:
at 10.00 % in dipropylene glycol.  		sweet ethereal green rum fruity berry
odor description:
Sweet, etherial, green, slight rum, with a fruity berry depth
Mosciano, Gerard P&F 17, No. 6, 41, (1992)
taste description:
at 50.00 ppm.  		Fruity, green, etherial, with a berry lift
Mosciano, Gerard P&F 17, No. 6, 41, (1992)
properties :
appearence :colorless to pale yellow clear liquid
assay : 97.00 to 100.00 %   
additional assay information :min 97% propyl formate + propyl alcohol
Food Chemicals Codex Listed :No
specific gravity :0.90300 to 0.90900 @ 20.00 °C.
pounds per gallon - calc. : 7.523 to 7.573
refractive index :1.37500 to 1.38000 @ 20.00 °C.
melting point : -93.00 to -92.00 °C. @ 760.00 mm Hg
boiling point : 80.00 to 82.00 °C. @ 760.00 mm Hg
boiling point : 28.00 to 29.00 °C. @ 100.00 mm Hg
vapor pressure :82.60000 mm/Hg @ 25.00 °C.
vapor density :3.00 ( Air = 1 )
flash point : 27.00  °F.  TCC  ( -2.78 °C. )
logP (o/w) : 0.83
safety :
most important hazard(s) :Xi - Irritant
  R 11 - Highly flammable.
R 36/37 - Irritating to eyes and respiratory system.
R 67 - Vapours may cause frowsiness and dizziness.
S 02 - Keep out of the reach of children.
S 09 - Keep container in a well-ventilated place.
S 16 - Keep away from sources of ignition - No Smoking.
S 23 - Do not breath vapour.
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 36/37/39 - Wear suitable clothing, gloves and eye/face protection.
Oral Toxicity(LD50) : 
  Oral-Rat    3980.00  mg/kg
Food and Cosmetics Toxicology. Vol. 2, Pg. 327, 1964.

Oral-Mouse    3400.00  mg/kg
Food and Cosmetics Toxicology. Vol. 2, Pg. 327, 1964.

Dermal Toxicity(LD50) : 
  Not determined
Inhalation Toxicity(LC50) : 
  Not determined
 
safety in use :
Category :flavor and fragrance agents
Maximised Survey-derived Daily Intakes (MSDI-EU) :5.00 (μg/capita/day)
 
recommendation for propyl formate fragrance usage levels up to :
  2.0000 % in the fragrance concentrate.
recommendation for propyl formate flavor usage levels up to :
  85.0000 ppm in the flavor.
safety references :
European Food Safety Athority(efsa) :Flavor usage levels; Subacute, Subchronic, Chronic and Carcinogenicity Studies; Developmental / Reproductive Toxicity Studies; Genotoxicity Studies...
EPI System :view
Canada Domestic Sub. List :Yes
EPA Chem. Sub. Inventory : Yes
WISER :UN 1281
 
WGK Germany :1
 
 
 
 
propyl formate
(EINECS) number :203-798-0
RTECS :LR0175000 for cas# 110-74-7
chemidplus :000110747
EPA/NOAA CAMEO :hazardous materials
EPA Substance Registry Services :110-74-7
 
 
 
propan-1-ol
(EINECS) number :200-746-9
RTECS :UH8225000 for cas# 71-23-8
chemidplus :000071238
EPA Substance Registry Services :71-23-8
dtp/nci :30300
references :
 
propyl formate
fl. number :09.073
jecfa number :117
NIST Chemistry WebBook :675392343
pubchem :151193
 
propan-1-ol
fl. number :02.002
jecfa number :82
pubchem :149205
Flavornet :71-23-8
other :
VCF-Online: VCF Volatile Compounds in Food
FDA Everything Added to Food in the United States (EAFUS)View
synonyms :
 formic acid propyl ester
N-propyl formate
 propyl methanoate
Similar Products:    note
 allyl formate
 amyl formate
isoamyl formate
para-anisyl formate
 benzyl formate
 bornyl formate
isobornyl formate
 butyl formate
isobutyl formate
sec-butyl formate
 carvyl formate
 cedryl formate
 cinnamyl formate
 citronellyl formate
para-cresyl formate
 cyclododecyl formate
 cyclohexyl formate
2-decalinyl formate
 decyl formate
 dimethyl benzyl carbinyl formate
 ethyl formate
 eugenyl formate
isoeugenyl formate
 furfuryl formate
S-furfuryl thioformate
 geranyl formate
 heptyl formate
(E)-2-hexen-1-yl formate
(E)-3-hexen-1-yl formate
3-hexen-1-yl formate
(Z)-3-hexen-1-yl formate
 hexyl formate
 linalyl formate
 menthadienyl formate
 menthyl formate
laevo-menthyl formate
2-methyl butyl formate
 methyl formate
 myrtenyl formate
 neryl formate
 nonisyl formate
 nonyl formate
 nopyl formate
 octyl formate
3-octyl formate
 phenethyl formate
2-phenoxyethyl formate
3-phenyl propyl formate
 prenyl formate
isopropyl formate
isopulegyl formate
 rhodinyl formate
 styralyl formate
 sulfuryl formate
 terpinyl formate
soluble in :
 alcohol
 ether
 water, 22000 mg/L @ 22C
insoluble in :
 water
potential blenders :    note
 acetalFL
 acetaldehyde 1,3-octane diol acetalFL
 acetaldehyde benzyl 2-methoxyethyl acetalFL/FR
 acetaldehyde dihexyl acetalFL/FR
 acetaldehyde diisoamyl acetalFL/FR
 acetaldehyde dimethyl acetalFL/FR
 acetaldehyde methyl hexyl acetalFR
 allyl amyl glycolateFR
 allyl butyrateFL/FR
 allyl tiglateFL
isoamyl benzoateFL/FR
isoamyl butyrateFL/FR
alpha-amyl cinnamaldehyde diethyl acetalFR
isoamyl formateFL/FR
 amyl hexanoateFL/FR
isoamyl isovalerateFL/FR
isoamyl octanoateFL/FR
 berry pentadienoateFL/FR
 boronia absoluteFL/FR
 buchu mercaptanFL/FR
 butyl 2-methyl butyrateFL/FR
 butyl isobutyrateFL/FR
isobutyl propionateFL/FR
 cherry pentenoateFL/FR
 citronellyl propionateFL/FR
 cognac heptanoneFL/FR
para-cresyl isobutyrateFL/FR
beta-cyclocitralFL/FR
2-cyclopentyl cyclopentanoneFL/FR
gamma-damasconeFR
alpha-decalactoneFR
3-decen-2-oneFL/FR
9-decenoic acidFL/FR
 diethyl malonateFL/FR
 dimethyl succinateFL/FR
6,8-dimethyl-2-nonanolFR
(E,E)-2,4-dodecadien-1-olFR
 ethyl (E)-2-hexenoateFL/FR
 ethyl (E)-2-octenoateFL
 ethyl (E)-4-decenoateFL/FR
 ethyl 2-cyclohexyl propionateFR
 ethyl 2-octenoateFL/FR
 ethyl 3-acetoxyhexanoateFL/FR
 ethyl 3,5,5-trimethyl hexanoateFR
 ethyl acetoacetateFL/FR
2-ethyl butyraldehydeFL
 ethyl formateFL/FR
 ethyl methyl-para-tolyl glycidateFL/FR
2-ethyl-4-butanolFL/FR
 fir carboxylateFR
 furfuryl propionateFL
(E)-geranyl acetoneFL/FR
 geranyl isovalerateFL/FR
 green dioxolaneFR
(E,E)-2,4-heptadien-1-olFL
 heptanal cyclic ethylene acetalFR
2-heptanolFL/FR
 heptyl acetateFL/FR
 heptyl isobutyrateFL/FR
 hexanal propylene glycol acetalFL/FR
2-hexen-1-alFL
(E)-2-hexen-1-al diethyl acetalFL
2-hexen-1-al diethyl acetalFL
2-hexen-1-olFL/FR
(Z)-3-hexen-1-yl (E)-2-hexenoateFL/FR
(Z)-3-hexen-1-yl 2-methyl-2-pentenoateFR
(E)-2-hexen-1-yl acetateFL/FR
(E)-3-hexen-1-yl acetateFL/FR
(Z)-3-hexen-1-yl acetateFL/FR
2-hexen-1-yl acetateFL/FR
(E)-2-hexen-1-yl formateFL/FR
(E)-2-hexen-1-yl hexanoateFL/FR
(Z)-3-hexen-1-yl hexanoateFL/FR
(Z)-3-hexen-1-yl isobutyrateFL/FR
(Z)-3-hexen-1-yl isovalerateFL/FR
(E)-2-hexen-1-yl propionateFL/FR
(E)-2-hexen-1-yl valerateFL
(Z)-3-hexen-1-yl valerateFL/FR
1-hexen-3-yl acetate 
 hexyl (E)-2-hexenoateFL
 hexyl 2-butenoateFL/FR
 hexyl acetateFL/FR
 hexyl butyrateFL/FR
 hexyl isobutyrateFL/FR
 hexyl isovalerateFL/FR
 hexyl octanoateFL/FR
 hexyl pivalateFR
 hexyl propionateFL/FR
 lily propanolFR
 linalyl hexanoateFL/FR
 melon valerateFL/FR
 methyl (E)-2-hexenoateFL
 methyl (E)-3-nonenoateFL/FR
 methyl (E)-3-nonenoateFL
 methyl 2-hexenoateFL/FR
 methyl 2-undecynoateFL
 methyl 4-pentenoateFL
2-methyl butyl 2-methyl butyrateFL/FR
(E)-methyl geranateFL/FR
 methyl heptanoateFL/FR
 methyl R-3-acetoxyhexanoate 
2-methyl valeraldehydeFL
 methyl valerateFL/FR
3-methyl valeric acidFL
(E)-2-methyl-2-octen-1-alFL
2-methyl-2-octen-1-alFL
3-methyl-3-pentanolFL
 nerolidyl isobutyrateFR
(E,E)-3,5-octadien-2-oneFL
 octen-1-yl cyclopentanoneFL/FR
 octyl 2-methyl butyrateFL/FR
 papaya isobutyrateFL/FR
(E)-2-penten-1-alFL/FR
2-pentyl furanFL/FR
 phenoxyethyl isobutyrateFL/FR
4-phenyl-2-butyl acetateFL/FR
 pineapple pentenoateFL/FR
 prenolFL/FR
 prenyl ethyl etherFL/FR
 prenyl hexanoateFL/FR
isopropyl 2-methyl butyrateFL/FR
alpha-isopropyl phenyl acetaldehydeFL/FR
 rhubarb undecaneFR
 sorbyl isobutyrateFL/FR
 tetrahydrofurfuryl butyrateFL/FR
 thiogeraniolFL/FR
 tiglaldehydeFL/FR
 timber dioxolaneFR
 tricyclodecyl acetateFR
 tropical indeneFR
 tropical thiazoleFL/FR
 violet dienyneFR
 woody acetateFR
potential uses :
 apple
 berry
 cherry
 currant
 fruit
 pineapple
 plum
 rum
natural occurrence in :    note
 apple  
 brandy  
 currant  
 currant black currant S
 pineapple  
 plum  

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