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Substance Name: Cyclohexanone, 2,2-diallyl-
RN: 5277-36-1
InChIKey: QFSGLPBMYINTJA-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H18-O

Molecular Weight

  • 178.273
 
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Names and Synonyms

Synonyms

  • 2,2-Diallylcyclohexanone
  • 2,2-Dwuallilocykloheksanon
  • 2,2-Dwuallilocykloheksanon [Polish]
  • 3-07-00-00616 (Beilstein Handbook Reference)
  • AI3-07264
  • BRN 2046177

Systematic Names

  • Cyclohexanone, 2,2-di-2-propenyl- (9CI)
  • Cyclohexanone, 2,2-diallyl-

Registry Numbers

CAS Registry Number

  • 5277-36-1

System Generated Number

  • 0005277361

Structure Descriptors

InChI

1S/C12H18O/c1-3-8-12(9-4-2)10-6-5-7-11(12)13/h3-4H,1-2,5-10H2

InChIKey

QFSGLPBMYINTJA-UHFFFAOYSA-N

Smiles

C1(C(CCCC1)(CC=C)CC=C)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1560mg/kg (1560mg/kg)   Dissertationes Pharmaceuticae et Pharmacologicae. Vol. 22, Pg. 89, 1970.