1191-16-8

Name Prenyl acetate
CAS 1191-16-8
EINECS(EC#) 214-730-4
Molecular Formula C7H12O2
MDL Number MFCD00036569
Molecular Weight 128.17
MOL File 1191-16-8.mol
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Chemical Properties

Melting point  -62.68°C (estimate)
Boiling point  151-152 °C752 mm Hg(lit.)
density  0.917 g/mL at 25 °C(lit.)
vapor pressure  2.6hPa at 20℃
FEMA  4202
refractive index  n20/D 1.43(lit.)
Fp  121 °F
storage temp.  Sealed in dry,Room Temperature
solubility  H2O: insoluble
form  neat
color  Colorless to Almost colorless
Specific Gravity 0.917
Odor at 1.00 % in propylene glycol. sweet fresh banana fruity jasmin ripe heliotrope balsam
biological source synthetic
Odor Type fruity
Water Solubility  4.3g/L at 20℃
JECFA Number 1827
Major Application flavors and fragrances
Cosmetics Ingredients Functions PERFUMING
InChI 1S/C7H12O2/c1-6(2)4-5-9-7(3)8/h4H,5H2,1-3H3
InChIKey XXIKYCPRDXIMQM-UHFFFAOYSA-N
SMILES CC(=O)OC\C=C(\C)C
LogP 2 at 23℃
CAS DataBase Reference 1191-16-8(CAS DataBase Reference)
NIST Chemistry Reference 2-Buten-1-ol, 3-methyl-, acetate(1191-16-8)
EPA Substance Registry System 1191-16-8(EPA Substance)
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Safety Data

Symbol(GHS)  Flame (GHS02)
GHS02
Signal word  Warning
Hazard statements  H303-H226
Precautionary statements  P241-P280a-P501a-P210-P233-P240-P241+P242+P243-P280-P303+P361+P353-P370+P378-P403+P235-P501
Risk Statements 
R10:Flammable.
Safety Statements 
S16:Keep away from sources of ignition-No smoking .
RIDADR  UN 3272 3/PG 3
WGK Germany  2
RTECS  EM9473700
TSCA  Yes
REACH Registrations Active
HazardClass  3
PackingGroup  III
HS Code  29153900
Storage Class 3 - Flammable liquids
Hazard Classifications Flam. Liq. 3
Safety Profile
Mildly toxic by ingestion. A skin irritant. When heated to decomposition it emits acrid smoke and irritating fumes.

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