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Substance Name: 1H-Pyrrole-3-acetic acid, 1-(3-chloro-2-methylphenyl)-2,5-dimethyl-
RN: 42779-87-3
InChIKey: JTSOCAUKPOQVME-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H16-Cl-N-O2

Molecular Weight

  • 277.7494
 
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Names and Synonyms

Synonyms

  • 1-(3-Chloro-2-methylphenyl)-2,5-dimethyl-1H-pyrrole-3-acetic acid
  • BRN 0420213

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 42779-87-3

System Generated Number

  • 0042779873

Structure Descriptors

InChI

1S/C15H16ClNO2/c1-9-7-12(8-15(18)19)11(3)17(9)14-6-4-5-13(16)10(14)2/h4-7H,8H2,1-3H3,(H,18,19)

InChIKey

JTSOCAUKPOQVME-UHFFFAOYSA-N

Smiles

Cc1cc(c(n1c2cccc(c2C)Cl)C)CC(=O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1700mg/kg (1700mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 11, Pg. 173, 1976.
mouse LD50 oral 1700mg/kg (1700mg/kg) BEHAVIORAL: ANALGESIA European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 11, Pg. 173, 1976.