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Substance Name: 2,4,6-Trinitroaniline
RN: 489-98-5
InChIKey: IAHOUQOWMXVMEH-UHFFFAOYSA-N

Molecular Formula

  • C6-H4-N4-O6

Molecular Weight

  • 228.12
 
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Names and Synonyms

Synonyms

  • 2,4,6-Trinitroaniline
  • AI3-28913
  • EINECS 207-703-3
  • NSC 4860
  • Picramide

Systematic Names

  • 2,4,6-Trinitroaniline
  • Aniline, 2,4,6-trinitro- (8CI)
  • Benzenamine, 1,4,6-trinitro-
  • Benzenamine, 2,4,6-trinitro-
  • Benzenamine, 2,4,6-trinitro- (9CI)

Superlist Names

  • Trinitroaniline or picramide
  • Trinitroaniline or picramide [UN0153] [Explosive 1.1D]
  • UN0153

Registry Numbers

CAS Registry Number

  • 489-98-5

System Generated Number

  • 0000489985

Structure Descriptors

InChI

1S/C6H4N4O6/c7-6-4(9(13)14)1-3(8(11)12)2-5(6)10(15)16/h1-2H,7H2

InChIKey

IAHOUQOWMXVMEH-UHFFFAOYSA-N

Smiles

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

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 193.5 deg C   EXP
log P (octanol-water) 1.110 (none)   EST
Atmospheric OH Rate Constant 2.13E-15 cm3/molecule-sec 25 EST

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