Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 3-Nitroaniline
RN: 99-09-2
UNII: CM50SM561T
InChIKey: XJCVRTZCHMZPBD-UHFFFAOYSA-N

Note

  • Used as a sole source of nitrogen , carbon and energy.

Classification Code

  • Mutation Data

Molecular Formula

  • C6-H6-N2-O2

Molecular Weight

  • 138.125
 
* denotes mobile formatted website

Links to Resources


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • 3-Nitroaniline
  • m-Nitroaniline

Synonyms

  • 1-Amino-3-nitrobenzene
  • 3-Aminonitrobenzene
  • 3-Nitroaniline
  • 3-Nitrobenzenamine
  • 3-Nitrophenylamine
  • AI3-52474
  • Amarthol Fast Orange R Base
  • Aniline, m-nitro-
  • Azobase MNA
  • Benzenamine, 3-nitro-
  • C.I. 37030
  • C.I. Azoic Diazo Component 7
  • CCRIS 2318
  • CI 37030
  • CI Azoic Diazo Component 7
  • Daito Orange Base R
  • Devol Orange R
  • Diazo Fast Orange R
  • EINECS 202-729-1
  • Fast Orange Base R
  • Fast Orange M Base
  • Fast Orange MM Base
  • Fast Orange R Base
  • Fast Orange R Salt
  • Hiltonil Fast Orange R Base
  • HSDB 2570
  • m-Aminonitrobenzene
  • m-Nitraniline
  • m-Nitroaminobenzene
  • m-Nitroaniline
  • m-Nitrophenylamine
  • MNA
  • Naphtoelan Orange R Base
  • Nitranilin
  • NSC 9574
  • Orange Base Irga I
  • UNII-CM50SM561T

Systematic Names

  • 3-Nitroaniline
  • Aniline, m-nitro-
  • Benzenamine, 3-nitro-
  • m-Nitroaniline

Superlist Names

  • m-Nitroaniline
  • m-Nitroaniline [UN1661] [Poison]
  • Nitroaniline, 3-
  • UN1661

Registry Numbers

CAS Registry Number

  • 99-09-2

FDA UNII

  • CM50SM561T

Other Registry Number

  • 12262-63-4

System Generated Number

  • 0000099092

Structure Descriptors

InChI

1S/C6H6N2O2/c7-5-2-1-3-6(4-5)8(9)10/h1-4H,7H2

InChIKey

XJCVRTZCHMZPBD-UHFFFAOYSA-N

Smiles

c1(cc(ccc1)N)[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
dog LDLo intraperitoneal 70mg/kg (70mg/kg) LUNGS, THORAX, OR RESPIRATION: DYSPNEA

LUNGS, THORAX, OR RESPIRATION: OTHER CHANGES

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD
Journal of Industrial Hygiene. Vol. 2, Pg. 247, 1920.
guinea pig LD50 oral 450mg/kg (450mg/kg) BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY)
Voprosy Kommunal'noi Gigieny. Problems of Communal Hygiene. Vol. 6, Pg. 89, 1966.
mouse LD50 oral 308mg/kg (308mg/kg)   Aerospace Medical Research Laboratory Report. Vol. TR-72-62, Pg. 1972,
quail LD50 oral 562mg/kg (562mg/kg)   Archives of Environmental Contamination and Toxicology. Vol. 12, Pg. 355, 1983.
rat LD50 oral 535mg/kg (535mg/kg)   Aerospace Medical Research Laboratory Report. Vol. TR-72-62, Pg. 1972,

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 114 deg C   EXP
Boiling Point 306 deg C   EXP
pKa Dissociation Constant 2.466 (none) 25 EXP
log P (octanol-water) 1.37 (none)   EXP
Water Solubility 1200 mg/L 24 EXP
Vapor Pressure 9.56E-05 mm Hg 25 EXP
Henry's Law Constant 7.91E-09 atm-m3/mole 25 EXP
Atmospheric OH Rate Constant 9.41E-12 cm3/molecule-sec 25 EST

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