Skip Navigation
ChemIDplus A TOXNET DATABASE LiteBrowseAdvanced

Substance Name: 2,3-Dinitrotoluene
RN: 602-01-7
UNII: BS660NHC83
InChIKey: DYSXLQBUUOPLBB-UHFFFAOYSA-N

Classification Codes

  • Mutation Data
  • Skin / Eye Irritant

Molecular Formula

  • C7-H6-N2-O4

Molecular Weight

  • 182.134
 
* denotes mobile formatted website

Links to Resources


Search for this InChIKey on the Web

Names and Synonyms

Name of Substance

  • 2,3-Dinitrotoluene

Synonyms

  • 1-Methyl-2,3-dinitrobenzene
  • 2,3-Dinitrotoluene
  • 2,3-Dinitrotoluol
  • 2,3-DNT
  • 4-05-00-00865 (Beilstein Handbook Reference)
  • Benzene, 1-methyl-2,3-dinitro-
  • BRN 2212428
  • CCRIS 2837
  • EINECS 210-013-5
  • HSDB 5499
  • Toluene, 2,3-dinitro-
  • UNII-BS660NHC83

Systematic Names

  • 2,3-Dinitrotoluene
  • Benzene, 1-methyl-2,3-dinitro-
  • Toluene, 2,3-dinitro-

Superlist Name

  • Toluene, 2,3-dinitro-

Registry Numbers

CAS Registry Number

  • 602-01-7

FDA UNII

  • BS660NHC83

System Generated Number

  • 0000602017

Structure Descriptors

InChI

1S/C7H6N2O4/c1-5-3-2-4-6(8(10)11)7(5)9(12)13/h2-4H,1H3

InChIKey

DYSXLQBUUOPLBB-UHFFFAOYSA-N

Smiles

c1(c([N+](=O)[O-])cccc1C)[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1072mg/kg (1072mg/kg)   National Technical Information Service. Vol. PB214-270,
rat LD50 oral 911mg/kg (911mg/kg) BEHAVIORAL: SOMNOLENCE (GENERAL DEPRESSED ACTIVITY) National Technical Information Service. Vol. AD-A080-146,

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 60 deg C   EXP
Boiling Point 284 deg C   EXP
log P (octanol-water) 2.180 (none)   EST
Water Solubility 220 mg/L 25 EST
Vapor Pressure 3.97E-04 mm Hg 25 EST
Henry's Law Constant 9.26E-08 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.92E-13 cm3/molecule-sec 25 EST

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