5205-11-8

Name BENZOIC ACID 3-METHYL-2-BUTENYL ESTER
CAS 5205-11-8
EINECS(EC#) 225-998-7
Molecular Formula C12H14O2
MDL Number MFCD00036570
Molecular Weight 190.24
MOL File 5205-11-8.mol
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Chemical Properties

Boiling point  107 °C / 2.3mmHg
density  1.03
FEMA  4203 | PRENYL BENZOATE
refractive index  1.5190-1.5210
Fp  134 °C
form  clear liquid
color  Colorless to Light orange to Yellow
Specific Gravity 1.020
Odor at 100.00 %. balsam fruity chocolate ylang tea
Odor Type balsamic
JECFA Number 2063
Major Application flavors and fragrances
Cosmetics Ingredients Functions PERFUMING
InChI 1S/C12H14O2/c1-10(2)8-9-14-12(13)11-6-4-3-5-7-11/h3-8H,9H2,1-2H3
InChIKey INVWRXWYYVMFQC-UHFFFAOYSA-N
SMILES C\C(C)=C\COC(=O)c1ccccc1
LogP 4.10
EPA Substance Registry System 2-Buten-1-ol, 3-methyl-, benzoate (5205-11-8)

Safety Data

Hazard Codes  N
Risk Statements 
Safety Statements 
WGK Germany  WGK 2
RTECS  EM9473900
TSCA  TSCA listed
HS Code  2916399090
Storage Class 11 - Combustible Solids
Hazard Classifications Aquatic Chronic 2
Safety Profile
Moderately toxic by ingestion. A skin irritant. When heated to decomposition it emits acrid smoke and irritating fumes.

Hazard Information

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