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Substance Name: 1H-Pyrrole-3-acetic acid, 1-(2-chlorophenyl)-2,5-dimethyl-, compd. with 2-aminoethanol (1:1)
RN: 60352-45-6
InChIKey: VPJIOZDSDULFMC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H14-Cl-N-O2.C2-H7-N-O

Molecular Weight

  • 324.8059
 
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Names and Synonyms

Synonym

  • 1-(2-Chlorophenyl)-2,5-dimethyl-1H-pyrrole-3-acetic acid compd. with 2-aminoethanol (1:1)

Systematic Name

  • 1H-Pyrrole-3-acetic acid, 1-(2-chlorophenyl)-2,5-dimethyl-, compd. with 2-aminoethanol (1:1)

Registry Numbers

CAS Registry Number

  • 60352-45-6

System Generated Number

  • 0060352456

Molecular Formulas

Molecular Formula

  • C14-H14-Cl-N-O2.C2-H7-N-O

Molecular Formula Fragments

  • C14-H14-Cl-N-O2
  • C2-H7-N-O
  • COMPONENT

Structure Descriptors

InChI

1S/C14H14ClNO2.C2H7NO/c1-9-7-11(8-14(17)18)10(2)16(9)13-6-4-3-5-12(13)15;3-1-2-4/h3-7H,8H2,1-2H3,(H,17,18);4H,1-3H2

InChIKey

VPJIOZDSDULFMC-UHFFFAOYSA-N

Smiles

Cc1cc(c(n1c2ccccc2Cl)C)CC(=O)O.C(CO)N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 1650mg/kg (1650mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 11, Pg. 173, 1976.
mouse LD50 oral 1650mg/kg (1650mg/kg) BEHAVIORAL: ANALGESIA European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 11, Pg. 173, 1976.