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Substance Name: Benzyl propionate
RN: 122-63-4
UNII: 307DN1208L
InChIKey: VHOMAPWVLKRQAZ-UHFFFAOYSA-N

Molecular Formula

  • C10-H12-O2

Molecular Weight

  • 164.203
 
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Names and Synonyms

Name of Substance

  • Benzyl propionate

Synonyms

  • AI3-02952
  • Benzyl propanoate
  • Benzyl propionate
  • Benzyl propionate (natrual)
  • EC 204-559-3
  • EINECS 204-559-3
  • FEMA No. 2150
  • NSC 46100
  • Phenylmethyl propanoate
  • Phenylmethyl propionate
  • Propanoic acid, phenylmethyl ester
  • Propionic acid, benzyl ester
  • UNII-307DN1208L

Systematic Names

  • Benzyl propionate
  • Propanoic acid, phenylmethyl ester
  • Propionic acid, benzyl ester (6CI,7CI,8CI)

Superlist Name

  • Benzyl propionate

Registry Numbers

CAS Registry Number

  • 122-63-4

FDA UNII

  • 307DN1208L

System Generated Number

  • 0000122634

Structure Descriptors

InChI

1S/C10H12O2/c1-2-10(11)12-8-9-6-4-3-5-7-9/h3-7H,2,8H2,1H3

InChIKey

VHOMAPWVLKRQAZ-UHFFFAOYSA-N

Smiles

c1(COC(CC)=O)ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rabbit LD50 skin > 5gm/kg (5000mg/kg)   Food and Cosmetics Toxicology. Vol. 13, Pg. 723, 1975.
rat LD50 oral 3300mg/kg (3300mg/kg)   Food and Cosmetics Toxicology. Vol. 13, Pg. 723, 1975.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Boiling Point 220 deg C   EXP
log P (octanol-water) 2.570 (none)   EST

Physical property data is provided to ChemIDplus by SRC, Inc.