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Substance Name: Benzenamine, N,N-dimethyl-4-nitro-
RN: 100-23-2
InChIKey: QJAIOCKFIORVFU-UHFFFAOYSA-N

Molecular Formula

  • C8-H10-N2-O2

Molecular Weight

  • 166.179
 
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Names and Synonyms

Synonyms

  • 1-(Dimethylamino)-4-nitrobenzene
  • 4-(Dimethylamino)nitrobenzene
  • 4-Nitro-N,N-dimethylaniline
  • 4-Nitrodimethylaniline
  • AI3-08886
  • Benzenamine, N,N-dimethyl-4-nitro-
  • EINECS 202-832-1
  • N,N-Dimethyl-4-nitroaniline
  • N,N-Dimethyl-p-nitroaniline
  • NSC 9815
  • p-(Dimethylamino)nitrobenzene
  • p-Nitro-N,N-dimethylaniline
  • p-Nitrodimethylaniline

Systematic Names

  • Aniline, N,N-dimethyl-p-nitro-
  • Benzenamine, N,N-dimethyl-4-nitro-
  • N,N-Dimethyl-4-nitroaniline

Registry Numbers

CAS Registry Number

  • 100-23-2

Other Registry Number

  • 508191-95-5

System Generated Number

  • 0000100232

Structure Descriptors

InChI

1S/C8H10N2O2/c1-9(2)7-3-5-8(6-4-7)10(11)12/h3-6H,1-2H3

InChIKey

QJAIOCKFIORVFU-UHFFFAOYSA-N

Smiles

c1(N(C)C)ccc([N+](=O)[O-])cc1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD oral > 500mg/kg (500mg/kg)   National Academy of Sciences, National Research Council, Chemical-Biological Coordination Center, Review. Vol. 5, Pg. 11, 1953.

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 164 deg C   EXP
pKa Dissociation Constant 0.607 (none) 25 EXP
log P (octanol-water) 2.27 (none)   EXP
Water Solubility 738 mg/L 25 EST
Henry's Law Constant 3.38E-07 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 4.88E-11 cm3/molecule-sec 25 EST

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