Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: Ethyl benzoate
RN: 93-89-0
UNII: J115BRJ15H
InChIKey: MTZQAGJQAFMTAQ-UHFFFAOYSA-N

Molecular Formula

  • C9-H10-O2

Molecular Weight

  • 150.176
 
* denotes mobile formatted website

Links to Resources


Search for this InChIKey on the Web

Names and Synonyms

Results Name

  • Ethyl benzoate

Name of Substance

  • Ethyl benzoate

Synonyms

  • AI3-01352
  • Benzoic acid, ethyl ester
  • Benzoic ether
  • Benzoyl ethyl ether
  • EC 202-284-3
  • EINECS 202-284-3
  • Ethyl benzenecarboxylate
  • Ethyl benzoate
  • Ethyl benzoate (natural)
  • Ethylester kyseliny benzoove
  • Ethylester kyseliny benzoove [Czech]
  • FEMA No. 2422
  • NSC 8884
  • UNII-J115BRJ15H

Systematic Names

  • Benzoic acid, ethyl ester
  • Ethyl benzoate

Superlist Names

  • Benzoic acid, ethyl ester
  • Ethyl benzoate

Registry Numbers

CAS Registry Number

  • 93-89-0

FDA UNII

  • J115BRJ15H

System Generated Number

  • 0000093890

Structure Descriptors

InChI

1S/C9H10O2/c1-2-11-9(10)8-6-4-3-5-7-8/h3-7H,2H2,1H3

InChIKey

MTZQAGJQAFMTAQ-UHFFFAOYSA-N

Smiles

CCOC(=O)c1ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
cat LDLo skin 10gm/kg (10000mg/kg) BEHAVIORAL: MUSCLE WEAKNESS

GASTROINTESTINAL: CHANGES IN STRUCTURE OR FUNCTION OF SALIVARY GLANDS

BEHAVIORAL: TREMOR
Journal of Pharmacology and Experimental Therapeutics. Vol. 84, Pg. 358, 1945.
rabbit LD50 oral 2630mg/kg (2630mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)

SKIN AND APPENDAGES (SKIN): HAIR: OTHER

BEHAVIORAL: MUSCLE WEAKNESS
Journal of Pharmacology and Experimental Therapeutics. Vol. 84, Pg. 358, 1945.
rat LD50 oral 2100mg/kg (2100mg/kg) SKIN AND APPENDAGES (SKIN): HAIR: OTHER

LUNGS, THORAX, OR RESPIRATION: DYSPNEA

BEHAVIORAL: MUSCLE WEAKNESS
Journal of Pharmacology and Experimental Therapeutics. Vol. 84, Pg. 358, 1945.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point -3.40E+01 deg C   EXP
Boiling Point 212 deg C   EXP
log P (octanol-water) 2.64 (none)   EXP
Water Solubility 720 mg/L 25 EXP
Vapor Pressure 0.267 mm Hg 25 EXP
Henry's Law Constant 7.33E-05 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 2.29E-12 cm3/molecule-sec 25 EST

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