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Benzyl isobutyrate Structure

Benzyl isobutyrate

  • Product NameBenzyl isobutyrate
  • CAS103-28-6
  • CBNumberCB6412414
  • MFC11H14O2
  • MW178.23
  • EINECS203-095-9
  • MDL NumberMFCD00048315
  • MOL File103-28-6.mol

Chemical Properties

Boiling point: 238 °C(lit.)
Density  1.003 g/mL at 25 °C(lit.)
vapor pressure  5.7Pa at 25℃
refractive index  n20/D 1.49(lit.)
FEMA  2141 | BENZYL ISOBUTYRATE
Flash point: 138 °F
storage temp.  Store at room temperature, keep dry and cool
form  clear liquid
color  Colorless to Almost colorless
Odor at 100.00 %. jasmin oily fruity sweet rose tropical
Odor Type floral
biological source synthetic
Water Solubility  989.48mg/L at 25℃
JECFA Number 844
BRN  1869299
Major Application flavors and fragrances
Cosmetics Ingredients Functions PERFUMING
InChI 1S/C11H14O2/c1-9(2)11(12)13-8-10-6-4-3-5-7-10/h3-7,9H,8H2,1-2H3
InChIKey UIKJRDSCEYGECG-UHFFFAOYSA-N
SMILES CC(C)C(=O)OCc1ccccc1
LogP 2.99 at 25℃
CAS DataBase Reference 103-28-6(CAS DataBase Reference)
NIST Chemistry Reference Propanoic acid, 2-methyl-, phenylmethyl ester(103-28-6)
EPA Substance Registry System Propanoic acid, 2-methyl-, phenylmethyl ester (103-28-6)

Safety

Symbol(GHS)  Flame (GHS02)
GHS02
Signal word  Warning
Hazard statements  H303
Precautionary statements  P270-P301+P312-P403-P501c
PPE Eyeshields, Faceshields, Gloves, type ABEK (EN14387) respirator filter
Risk Statements  10
Safety Statements  16-24/25
RIDADR  UN 3272 3/PG 3
WGK Germany  1
RTECS  NQ4550000
TSCA  TSCA listed
HS Code  29156000
Storage Class 3 - Flammable liquids
Hazard Classifications Flam. Liq. 3
Toxicity The acute oral LD50 in rats was found to be 2850 mg/kg. The acute dermal LD50 was reported to be > 5 ml/kg in the rabbit
REACH Registrations Inactive
NFPA 704:
1
0 0

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