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Substance Name: 2-Cyclohexen-1-one, 3-((2,3-dichlorophenyl)amino)-5,5-dimethyl-
RN: 100445-54-3
InChIKey: XKOVPXDPRUZPGN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C14-H15-Cl2-N-O

Molecular Weight

  • 284.1845
 
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Names and Synonyms

Synonyms

  • 3-((2,3-Dichlorophenyl)amino)-5,5-dimethyl-2-cyclohexen-1-one
  • 3-(2,3-Dichloroanilino)-5,5-dimethyl-2-cyclohexen-1-one

Systematic Name

  • 2-Cyclohexen-1-one, 3-((2,3-dichlorophenyl)amino)-5,5-dimethyl-

Registry Numbers

CAS Registry Number

  • 100445-54-3

System Generated Number

  • 0100445543

Structure Descriptors

InChI

1S/C14H15Cl2NO/c1-14(2)7-9(6-10(18)8-14)17-12-5-3-4-11(15)13(12)16/h3-6,17H,7-8H2,1-2H3

InChIKey

XKOVPXDPRUZPGN-UHFFFAOYSA-N

Smiles

CC1(CC(=CC(=O)C1)Nc2cccc(c2Cl)Cl)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intraperitoneal > 1200mg/kg (1200mg/kg)   Japanese Kokai Tokyo Koho Patents. Vol. #92-282314,