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Substance Name: Cyclopentanone, 2-(1,3-benzodioxol-5-ylmethylene)-
RN: 69920-36-1
InChIKey: WGPZONFYCCSFLS-UXBLZVDNSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H12-O3

Molecular Weight

  • 216.2348
 
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Names and Synonyms

Synonym

  • 2-(1,3-Benzodioxol-5-ylmethylene)cyclopentanone

Systematic Name

  • Cyclopentanone, 2-(1,3-benzodioxol-5-ylmethylene)-

Registry Numbers

CAS Registry Number

  • 69920-36-1

System Generated Number

  • 0069920361

Structure Descriptors

InChI

1S/C13H12O3/c14-11-3-1-2-10(11)6-9-4-5-12-13(7-9)16-8-15-12/h4-7H,1-3,8H2/b10-6+

InChIKey

WGPZONFYCCSFLS-UXBLZVDNSA-N

Smiles

c1cc2c(cc1/C=C/3\CCCC3=O)OCO2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1300mg/kg (1300mg/kg)   German Offenlegungsschrift Patent Document. Vol. #2833880,