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Substance Name: 1-Cyclohexene-1-acetic acid, alpha-methyl-4-(1-methylcyclopentyl)-
RN: 28673-63-4
InChIKey: KYEAFFQTYWXOME-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C15-H24-O2

Molecular Weight

  • 236.353
 
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Names and Synonyms

Synonyms

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

Systematic Name

  • 1-Cyclohexene-1-acetic acid, alpha-methyl-4-(1-methylcyclopentyl)-

Registry Numbers

CAS Registry Number

  • 28673-63-4

System Generated Number

  • 0028673634

Structure Descriptors

InChI

1S/C15H24O2/c1-11(14(16)17)12-5-7-13(8-6-12)15(2)9-3-4-10-15/h5,11,13H,3-4,6-10H2,1-2H3,(H,16,17)

InChIKey

KYEAFFQTYWXOME-UHFFFAOYSA-N

Smiles

C1(=CC[C@@H](CC1)C1(CCCC1)C)[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,