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Substance Name: 1H-Pyrrole, 1-butyl-2,4-dinitro- (9CI)
RN: 2881-70-1
InChIKey: OJFAVJXGMKHJKM-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C8-H11-N3-O4

Molecular Weight

  • 213.192
 
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Names and Synonyms

Synonyms

  • 1-Butyl-2,4-dinitro-1H-pyrrole
  • 1-Butyl-2,4-dinitropyrrole
  • BRN 1623869
  • ORF 1460

Systematic Names

  • 1H-Pyrrole, 1-butyl-2,4-dinitro- (9CI)
  • Pyrrole, 1-butyl-2,4-dinitro-

Registry Numbers

CAS Registry Number

  • 2881-70-1

System Generated Number

  • 0002881701

Structure Descriptors

InChI

1S/C8H11N3O4/c1-2-3-4-9-6-7(10(12)13)5-8(9)11(14)15/h5-6H,2-4H2,1H3

InChIKey

OJFAVJXGMKHJKM-UHFFFAOYSA-N

Smiles

n1(c(cc(c1)[N+](=O)[O-])[N+](=O)[O-])CCCC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1200mg/kg (1200mg/kg)   Journal of Pharmacy and Pharmacology. Vol. 17, Pg. 747, 1965.