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Substance Name: Benzenamine, 2,4-dinitro-N-phenyl-
RN: 961-68-2
InChIKey: RHTVQEPJVKUMPI-UHFFFAOYSA-N

Molecular Formula

  • C12-H9-N3-O4

Molecular Weight

  • 259.22
 
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Names and Synonyms

Synonyms

  • 2,4-Dinitrodiphenylamine
  • 4-12-00-01692 (Beilstein Handbook Reference)
  • Acetoquinone Yellow 5JZ
  • AI3-02914
  • BRN 1996954
  • C.I. 10340
  • C.I. Disperse Yellow 14
  • EINECS 213-508-4
  • N-(2,4-Dinitrophenyl)aniline
  • N-Phenyl-2,4-dinitroaniline
  • NSC 6150
  • o,p-Dinitrodiphenylamine
  • Serisol Yellow 2G
  • Supracet Yellow 3G

Systematic Names

  • 2,4-Dinitro-N-phenylaniline
  • Benzenamine, 2,4-dinitro-N-phenyl-
  • Diphenylamine, 2,4-dinitro-

Registry Numbers

CAS Registry Number

  • 961-68-2

System Generated Number

  • 0000961682

Structure Descriptors

InChI

1S/C12H9N3O4/c16-14(17)10-6-7-11(12(8-10)15(18)19)13-9-4-2-1-3-5-9/h1-8,13H

InChIKey

RHTVQEPJVKUMPI-UHFFFAOYSA-N

Smiles

c1(c(cc([N+](=O)[O-])cc1)[N+](=O)[O-])Nc1ccccc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 180mg/kg (180mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#06394,

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 159 deg C   EXP
log P (octanol-water) 3.500 (none)   EST
Water Solubility 38 mg/L 15 EXP
Henry's Law Constant 7.75E-10 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.49E-10 cm3/molecule-sec 25 EST

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