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Substance Name: o-Aminoacetophenone
RN: 551-93-9
UNII: 69Y77091BC
InChIKey: GTDQGKWDWVUKTI-UHFFFAOYSA-N

Molecular Formula

  • C8-H9-N-O

Molecular Weight

  • 135.165
 
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Names and Synonyms

Name of Substance

  • 2-Aminoacetophenone
  • o-Aminoacetophenone

Synonyms

  • 1-Acetyl-2-aminobenzene
  • 2'-Amonioacetophenone
  • 2-Acetylaniline
  • 2-Aminoacetophenone
  • Acetophenone, 2'-amino-
  • AI3-04095
  • EINECS 209-002-8
  • Ethanone, 1-(2-aminophenyl)-
  • HSDB 5494
  • NSC 8820
  • o-Acetylaniline
  • o-Aminoacetophenone
  • o-Aminoacetylbenzene
  • UNII-69Y77091BC

Systematic Names

  • 2'-Aminoacetophenone
  • Acetophenone, 2'-amino- (8CI)
  • Ethanone, 1-(2-aminophenyl)-

Registry Numbers

CAS Registry Number

  • 551-93-9

FDA UNII

  • 69Y77091BC

Related Registry Number

  • 25384-14-9 (hydrochloride)

System Generated Number

  • 0000551939

Structure Descriptors

InChI

1S/C8H9NO/c1-6(10)7-4-2-3-5-8(7)9/h2-5H,9H2,1H3

InChIKey

GTDQGKWDWVUKTI-UHFFFAOYSA-N

Smiles

c1(c(cccc1)N)C(C)=O

Physical Properties

Physical Property Value Units Temp (deg C) Source
pKa Dissociation Constant 2.22 (none) 25 EXP
log P (octanol-water) 1.63 (none)   EXP
Water Solubility 3560 mg/L 25 EST
Vapor Pressure 9.89E-03 mm Hg 25 EST
Henry's Law Constant 3.47E-09 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 9.82E-11 cm3/molecule-sec 25 EST

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