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Substance Name: 1H-Pyrrole-3-acetic acid, 1-(2,5-dichlorophenyl)-2,5-dimethyl-
RN: 42780-30-3
InChIKey: LCQUMGZPWILQKO-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H13-Cl2-N-O2

Molecular Weight

  • 298.168
 
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Names and Synonyms

Synonyms

  • 1-(2,5-Dichlorophenyl)-2,5-dimethyl-1H-pyrrole-3-acetic acid
  • BRN 0425106

Systematic Name

  • 1H-Pyrrole-3-acetic acid, 1-(2,5-dichlorophenyl)-2,5-dimethyl-

Registry Numbers

CAS Registry Number

  • 42780-30-3

System Generated Number

  • 0042780303

Structure Descriptors

InChI

1S/C14H13Cl2NO2/c1-8-5-10(6-14(18)19)9(2)17(8)13-7-11(15)3-4-12(13)16/h3-5,7H,6H2,1-2H3,(H,18,19)

InChIKey

LCQUMGZPWILQKO-UHFFFAOYSA-N

Smiles

n1(c(c(cc1C)CC(=O)O)C)c1c(ccc(c1)Cl)Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 2400mg/kg (2400mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 11, Pg. 173, 1976.