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Substance Name: 3-Aminobenzamide
RN: 3544-24-9
UNII: 8J365YF1YH
InChIKey: GSCPDZHWVNUUFI-UHFFFAOYSA-N

Note

  • Inhibitor of poly ADP ribose synthetase.

Molecular Formula

  • C7-H8-N2-O

Molecular Weight

  • 136.153
 

Classification Codes

  • Antineoplastic Agents
  • Central Nervous System Agents
  • Enzyme Inhibitors
  • Mutation Data
  • Neuroprotective Agents
  • Poly(ADP-ribose) Polymerase Inhibitors
  • Protective Agents
  • Radiation-Sensitizing Agents
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Names and Synonyms

Name of Substance

  • 3-Aminobenzamide

Synonyms

  • 3-Aminobenzamide
  • 3-Aminobenzimide
  • 4-14-00-01094 (Beilstein Handbook Reference)
  • BRN 2802373
  • CCRIS 3925
  • EINECS 222-586-9
  • HSDB 7581
  • m-Aminobenzamide
  • NSC 36962
  • UNII-8J365YF1YH

Systematic Names

  • 3-Aminobenzamide
  • Benzamide, 3-amino- (9CI)
  • Benzamide, m-amino-
  • m-Aminobenzamide

Registry Numbers

CAS Registry Number

  • 3544-24-9

FDA UNII

  • 8J365YF1YH

System Generated Number

  • 0003544249

Structure Descriptors

InChI

1S/C7H8N2O/c8-6-3-1-2-5(4-6)7(9)10/h1-4H,8H2,(H2,9,10)

InChIKey

GSCPDZHWVNUUFI-UHFFFAOYSA-N

Smiles

c1(cc(C(N)=O)ccc1)N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
bird - wild LD50 oral 1gm/kg (1000mg/kg)   Archives of Environmental Contamination and Toxicology. Vol. 12, Pg. 355, 1983.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 115-116 deg C   EXP
log P (octanol-water) -0.33 (none)   EXP
Water Solubility 8140 mg/L 25 EST
Vapor Pressure 2.63E-05 mm Hg 25 EST
Henry's Law Constant 7.83E-13 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 4.74E-11 cm3/molecule-sec 25 EST

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