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Substance Name: 1-Cyclohexene-1-acetic acid, 4-cyclohexyl-alpha-methyl-
RN: 28673-51-0
InChIKey: VKNIBPAITNJYAK-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H24-O2

Molecular Weight

  • 236.353
 
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Names and Synonyms

Synonyms

  • 4-Cyclohexyl-alpha-methyl-1-cyclohexene-1-acetic acid
  • Acide alpha-(cyclohexyl-4 cyclohexen-1 yl) propionique
  • Acide alpha-(cyclohexyl-4 cyclohexen-1 yl) propionique [French]
  • Propanoic acid, 2-(4-cyclohexyl-1-cyclohexen-1-yl)-

Systematic Name

  • 1-Cyclohexene-1-acetic acid, 4-cyclohexyl-alpha-methyl-

Registry Numbers

CAS Registry Number

  • 28673-51-0

System Generated Number

  • 0028673510

Structure Descriptors

InChI

1S/C15H24O2/c1-11(15(16)17)12-7-9-14(10-8-12)13-5-3-2-4-6-13/h7,11,13-14H,2-6,8-10H2,1H3,(H,16,17)

InChIKey

VKNIBPAITNJYAK-UHFFFAOYSA-N

Smiles

C1(=CC[C@@H](CC1)C1CCCCC1)[C@@H](C(=O)O)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 150mg/kg (150mg/kg)   Belgian Patent Document. Vol. #740469,
mouse LD50 oral > 750mg/kg (750mg/kg)   Belgian Patent Document. Vol. #740469,