butyl propionate
Suppliers  organoleptics  properties  safety  references  cosmetics    FEMA Index    Home Page
 
Right Click Picture For More Options. (Safari 1.2 (v125) Compatible).
 
IUPAC name :butyl propanoate
InChI :InChI=1/C7H14O2/c1-3-5-6-9-7(8)4-2/h3-6H2,1-2H3
InChIKey :BTMVHUNTONAYDX-UHFFFAOYAE
SMILES :CCCCOC(=O)CC
cas number :590-01-2
(EINECS) number :209-669-5
eu annex :607-029-00-3
beilstein number :1700932
fema number :2211
coe number :405
jecfa number :143
fl. number :09.124
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 : 1.80
XlogP3 : 2.10
molecular weight : 130.1848600 (IUPAC)
formula :C7 H14 O2
NMR Predictor :Predict
 
 
export tariff code :2915.50.3000
fda reg :172.515

Suppliers :
Advanced Biotech :butyl propionate
98% min. natural
Odor:  Herbaceous, Fruity
Cargill - Alfrebro :n-BUTYL PROPIONATE
natural, Kosher
Fontarome :BUTYL PROPIONATE
Odor:  Earthy, faintly sweet
Grau Aromatics :BUTYL-PROPIONATE
NI, Kosher
Inoue :BUTYL PROPIONATE
Mooreganics :Butyl Propionate
Natural
Penta :butyl propionate
Sigma-Aldrich-SAFC :Butyl propionate
≥98%, Kosher
Odor:  banana; ethereal
Vigon :Butyl Propionate

organoleptics :
odor type :fruity
odor strength :medium
odor description :
at 100.00 %.  
earthy sweet weak rose

properties :
appearence :colorless clear liquid
assay : 98.00 to 100.00 %   
Food Chemicals Codex Listed :No
specific gravity :0.87500 @ 25.00 °C.
specific gravity :0.87950 to 0.88250 @ 15.00 °C.
pounds per gallon - calc. : 7.333 to 7.358
refractive index :1.40200 @ 20.00 °C.
refractive index :1.40000 to 1.40200 @ 20.00 °C.
boiling point : 145.00 °C. @ 756.00 mm Hg
boiling point : 145.00 to 146.00 °C. @ 760.00 mm Hg
acid value : 0.20  max.  KOH/g
vapor pressure :4.42000 mm/Hg @ 25.00 °C.
vapor density :4.5 ( Air = 1 )
flash point : 101.00  °F.  TCC  ( 38.33 °C. )
logP (o/w) : 2.34
shelf life : 24.00 month(s) or longer if stored properly.
storage :store in cool, dry place in tightly sealed containers, protected from heat and light.

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 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) :
  Oral-Rat    5000.00  mg/kg
Food and Cosmetics Toxicology. Vol. 18, Pg. 661, 1980.

Dermal Toxicity(LD50) :
  Skin-Rabbit  >14000.00  mg/kg
Acute Toxicity Data. Journal of the American College of Toxicology, Part B. Vol. 1, Pg. 192, 1992.

Inhalation Toxicity(LC50) :
  Not determined
 

safety in use :
Maximised Survey-derived Daily Intakes (MSDI-EU) :10.00 (μg/capita/day)
 
recommendation for butyl propionate usage levels up to :
  4.0000 % in the fragrance concentrate.
recommendation for butyl propionate usage levels up to :
  30.0000 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
NIOSH International Chemical Safety Cards :search
Cancer Citations :Search
Toxicology Citations :Search
NLM Developmental and Reproductive Toxicity :Search
Canada Domestic Sub. List :Yes
EPA Chem. Sub. Inventory : Yes
WISER :UN 1914
 
WGK Germany :1
 
 
 
 butyl propanoate
(EINECS) number :209-669-5
RTECS :590-01-2
chemidplus :000590012
EPA/NOAA CAMEO :hazardous materials
EPA Substance Registry Services :590-01-2

references :
 butyl propanoate
fl. number :09.124
jecfa number :143
NIST Chemistry WebBook :2273899249
pubchem :154833

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 :
 butyl propanoate
N-butyl propanoate
N-butyl propionate
 propanoic acid butyl ester
 propionic acid butyl ester

soluble in :
 alcohol
 ether
 water, 1500 mg/L @ 20C

insoluble in :
 water

(odor and/or flavor) blends with :
 allyl cyclohexyl acetate
 allyl isononylate
 allyl isovalerate
 allyl phenyl acetate
 allyl propionate
 allyl salicylate
 amyl acetate
isoamyl acetate
 amyl butyrate
 amyl heptanoate
isoamyl hexanoate
isoamyl propionate
 amyl valerate
 benzyl isobutyrate
 berry pentadienoate
 butyl acetate
 butyl angelate
isobutyl propionate
 cassis buteneone
laevo-citronellyl acetate
 cyclohexanone diethyl acetal
 cyclohexyl formate
 cyclohexyl propionate
beta-damascenone
delta-damascone
 diethyl maleate
 dihydroactinidolide
 dimethyl benzyl carbinyl acetate
 ethyl acetate
2-ethyl butyl acetate
 ethyl hydrocinnamate
 ethyl isovalerate
 ethyl methyl mercaptopropionate
 ethyl nonanoate
 ethyl propionate
 ethyl pyruvate
 ethyl salicylate
(E)-ethyl tiglate
 fruity carboxylate
 furfuryl acetate
 furfuryl isovalerate
 geraniol
 geranyl butyrate
 geranyl propionate
1-hexen-3-yl acetate
 hexyl phenyl acetate
 linalyl butyrate
 linalyl formate
 methyl 2-methyl butyrate
 methyl 4-methyl valerate
2-methyl butyl isovalerate
 methyl propionate
 octyl formate
 phenethyl isobutyrate
 phenethyl isovalerate
 phenethyl valerate
2-phenyl propyl butyrate
 prenyl acetate
 prenyl formate
isopropyl acetate
 propyl heptanoate
 propyl isobutyrate
isopropyl octanoate
 rhodinyl butyrate
 santalyl butyrate

(odor and/or flavor) used in :
 apple
 apricot
 banana
 blackberry
 earth humus
 grape
 melon
 mushroom
 peach
 pear
 pineapple
 plum
 raspberry
 starfruit
 strawberry
 tropical

natural occurrence in :
apple
banana
blackberry
grape cherimoya grape
melon
mushroom
plum
raspberry
starfruit
strawberry



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 © 1980-2009 The Good Scents Company Disclaimer Privacy Policy
Html Last modified 11/06/2009