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Substance Name: Cyclopentanol, 2-(1,3-benzodioxol-5-ylmethylene)-
RN: 69920-47-4
InChIKey: PQLVLMKIYAPVBL-UXBLZVDNSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H14-O3

Molecular Weight

  • 218.2506
 
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Names and Synonyms

Synonym

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

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 69920-47-4

System Generated Number

  • 0069920474

Structure Descriptors

InChI

1S/C13H14O3/c14-11-3-1-2-10(11)6-9-4-5-12-13(7-9)16-8-15-12/h4-7,11,14H,1-3,8H2/b10-6+

InChIKey

PQLVLMKIYAPVBL-UXBLZVDNSA-N

Smiles

c1cc2c(cc1/C=C/3\CCCC3O)OCO2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 100mg/kg (100mg/kg)   German Offenlegungsschrift Patent Document. Vol. #2833880,