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Substance Name: alpha-Phenylacetamide
RN: 103-81-1
UNII: 5R219M9TJF
InChIKey: LSBDFXRDZJMBSC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C8-H9-N-O

Molecular Weight

  • 135.1651
 
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Names and Synonyms

Name of Substance

  • 2-Phenylacetamide
  • alpha-Phenylacetamide

Synonyms

  • 2-Phenylacetamide
  • AI3-19421
  • alpha-Phenylacetamide
  • alpha-Toluamide
  • alpha-Toluimidic acid
  • EINECS 203-147-0
  • NSC 1877
  • Phenyl-beta-acetylamine
  • Phenylacetic acid amide
  • UNII-5R219M9TJF

Systematic Names

  • 2-Phenylacetamide
  • Acetamide, 2-phenyl-
  • Benzeneacetamide

Registry Numbers

CAS Registry Number

  • 103-81-1

FDA UNII

  • 5R219M9TJF

Other Registry Number

  • 4463-20-1

System Generated Number

  • 0000103811

Structure Descriptors

InChI

1S/C8H9NO/c9-8(10)6-7-4-2-1-3-5-7/h1-5H,6H2,(H2,9,10)

InChIKey

LSBDFXRDZJMBSC-UHFFFAOYSA-N

Smiles

NC(=O)Cc1ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 430mg/kg (430mg/kg)   Pharmaceutical Chemistry Journal Vol. 10, Pg. 579, 1976.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 157 deg C   EXP
log P (octanol-water) 0.45 (none)   EXP
Water Solubility 3.62E+04 mg/L 25 EST
Vapor Pressure 3.44E-04 mm Hg 25 EST
Henry's Law Constant 9.03E-10 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 7.55E-12 cm3/molecule-sec 25 EST

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