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Substance Name: o-Cresol, dinitro-
RN: 1335-85-9
InChIKey: IUOFDOCUNLJHFO-UHFFFAOYSA-N

Molecular Formula

  • C7-H6-N2-O5

Molecular Weight

  • 198.1334
 
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Names and Synonyms

Synonyms

  • 2-Methyldinitrophenol
  • Dinitro-o-cresol

Systematic Names

  • o-Cresol, dinitro-
  • Phenol, 2-methyldinitro-
  • Phenol, 2-methyldinitro- (9CI)

Registry Numbers

CAS Registry Number

  • 1335-85-9

System Generated Number

  • 0001335859

Structure Descriptors

InChI

1S/C7H6N2O5/c1-4-6(10)3-2-5(8(11)12)7(4)9(13)14/h2-3,10H,1H3

InChIKey

IUOFDOCUNLJHFO-UHFFFAOYSA-N

Smiles

Cc1c(O)ccc(c1[N+](=O)[O-])[N+](=O)[O-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
rat LD50 unreported 125mg/kg (125mg/kg)   Soobshcheniia Akademii Nauk Gruzinskoi SSR. Vol. 65, Pg. 485, 1972.