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Substance Name: 4,4'-Dinitrocarbanilide
RN: 587-90-6
UNII: 9IDD210E75
InChIKey: JEZZOKXIXNSKQD-UHFFFAOYSA-N

Note

  • Component of NICARBAZIN.

Molecular Formula

  • C13-H10-N4-O5

Molecular Weight

  • 302.245
 
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Names and Synonyms

Name of Substance

  • 4,4'-Dinitrocarbanilide

Synonyms

  • 4,4'-Dinitrocarbanilide
  • 4,4'-Dinitrodiphenylurea
  • AI3-28268
  • DNC
  • EINECS 209-607-7
  • N,N'-Bis(p-nitrophenyl)urea
  • N,N'-Di(p-nitrophenyl)urea
  • NSC 101086
  • UNII-9IDD210E75
  • Urea, 1,3-bis(p-nitrophenyl)-

Systematic Names

  • 1,3-Bis(4-nitrophenyl)urea
  • Carbanilide, 4,4'-dinitro- (8CI)
  • Urea, N,N'-bis(4-nitrophenyl)-

Registry Numbers

CAS Registry Number

  • 587-90-6

FDA UNII

  • 9IDD210E75

System Generated Number

  • 0000587906

Structure Descriptors

InChI

1S/C13H10N4O5/c18-13(14-9-1-5-11(6-2-9)16(19)20)15-10-3-7-12(8-4-10)17(21)22/h1-8H,(H2,14,15,18)

InChIKey

JEZZOKXIXNSKQD-UHFFFAOYSA-N

Smiles

O=C(Nc1ccc([N+]([O-])=O)cc1)Nc1ccc([N+]([O-])=O)cc1

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 312 dec deg C   EXP
log P (octanol-water) 3.760 (none)   EST
Atmospheric OH Rate Constant 1.07E-11 cm3/molecule-sec 25 EST

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