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Substance Name: 1H-Pyrrole-3-acetic acid, 2,5-dimethyl-1-(3,4-dimethylphenyl)-
RN: 42780-29-0
InChIKey: MLSVYUNSGGHQSF-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C16-H19-N-O2

Molecular Weight

  • 257.331
 
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Names and Synonyms

Synonyms

  • 2,5-Dimethyl-1-(3,4-dimethylphenyl)-1H-pyrrole-3-acetic acid
  • BRN 0407782

Systematic Name

  • 1H-Pyrrole-3-acetic acid, 2,5-dimethyl-1-(3,4-dimethylphenyl)-

Registry Numbers

CAS Registry Number

  • 42780-29-0

System Generated Number

  • 0042780290

Structure Descriptors

InChI

1S/C16H19NO2/c1-10-5-6-15(7-11(10)2)17-12(3)8-14(13(17)4)9-16(18)19/h5-8H,9H2,1-4H3,(H,18,19)

InChIKey

MLSVYUNSGGHQSF-UHFFFAOYSA-N

Smiles

n1(c(c(cc1C)CC(=O)O)C)c1cc(c(cc1)C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1950mg/kg (1950mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 11, Pg. 173, 1976.
mouse LD50 oral 1950mg/kg (1950mg/kg) BEHAVIORAL: ANALGESIA European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 11, Pg. 173, 1976.