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Substance Name: 3,5-Dinitro-o-toluic acid
RN: 28169-46-2
UNII: 025937BG8P
InChIKey: CDVNZMKTJIBBBV-UHFFFAOYSA-N

Molecular Formula

  • C8-H6-N2-O6

Molecular Weight

  • 226.143
 
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Names and Synonyms

Name of Substance

  • 3,5-Dinitro-o-toluic acid

Synonyms

  • 2-Methyl-3,5-dinitrobenzoic acid
  • 3,5-Dinitro-o-toluic acid
  • 3,5-Dinitrotoluic acid
  • EINECS 248-880-7
  • NSC 168527
  • o-Toluic acid, 3,5-dinitro-
  • UNII-025937BG8P

Systematic Names

  • 3,5-Dinitro-o-toluic acid
  • Benzoic acid, 2-methyl-3,5-dinitro-

Registry Numbers

CAS Registry Number

  • 28169-46-2

FDA UNII

  • 025937BG8P

Other Registry Number

  • 857153-70-9

System Generated Number

  • 0028169462

Structure Descriptors

InChI

1S/C8H6N2O6/c1-4-6(8(11)12)2-5(9(13)14)3-7(4)10(15)16/h2-3H,1H3,(H,11,12)

InChIKey

CDVNZMKTJIBBBV-UHFFFAOYSA-N

Smiles

[N+](c1c(c(C(=O)O)cc([N+]([O-])=O)c1)C)([O-])=O