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Substance Name: 1-Penten-3-ol, 1-(2-chloro-4,5-methylenedioxyphenyl)-4-methyl-
RN: 58345-03-2
InChIKey: RRDSKDGCAFHCRD-ONEGZZNKSA-N

Molecular Formula

  • C13-H15-Cl-O3

Molecular Weight

  • 254.7115
 
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Names and Synonyms

Synonyms

  • 1-(2-Chloro-4,5-methylenedioxyphenyl)-4-methyl-1-penten-3-ol
  • BRN 1317691

Systematic Name

  • 1-Penten-3-ol, 1-(2-chloro-4,5-methylenedioxyphenyl)-4-methyl-

Registry Numbers

CAS Registry Number

  • 58345-03-2

System Generated Number

  • 0058345032

Structure Descriptors

InChI

1S/C13H15ClO3/c1-8(2)11(15)4-3-9-5-12-13(6-10(9)14)17-7-16-12/h3-6,8,11,15H,7H2,1-2H3/b4-3+

InChIKey

RRDSKDGCAFHCRD-ONEGZZNKSA-N

Smiles

CC(C)C(/C=C/c1cc2c(cc1Cl)OCO2)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 750mg/kg (750mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 13, Pg. 41, 1978.