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Substance Name: 1-Hepten-3-ol, 1-(2-chloro-4,5-methylenedioxyphenyl)-6-methyl-
RN: 58345-05-4
InChIKey: LCLWFMKTPZFRJQ-GQCTYLIASA-N

Molecular Formula

  • C15-H19-Cl-O3

Molecular Weight

  • 282.765
 
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Names and Synonyms

Synonyms

  • 1-(2-Chloro-4,5-methylenedioxyphenyl)-6-methyl-1-hepten-3-ol
  • BRN 1319672

Systematic Name

  • 1-Hepten-3-ol, 1-(2-chloro-4,5-methylenedioxyphenyl)-6-methyl-

Registry Numbers

CAS Registry Number

  • 58345-05-4

System Generated Number

  • 0058345054

Structure Descriptors

InChI

1S/C15H19ClO3/c1-10(2)3-5-12(17)6-4-11-7-14-15(8-13(11)16)19-9-18-14/h4,6-8,10,12,17H,3,5,9H2,1-2H3/b6-4+

InChIKey

LCLWFMKTPZFRJQ-GQCTYLIASA-N

Smiles

c12c(cc(Cl)c(c1)\C=C\[C@@H](CCC(C)C)O)OCO2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1500mg/kg (1500mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 13, Pg. 41, 1978.