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Substance Name: Benzenemethanol, alpha-(2-(6-bromo-1,3-benzodioxol-5-yl)ethenyl)-2,5-dimethoxy-
RN: 58345-01-0
InChIKey: CIJMACSTFFCMJN-HWKANZROSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C18-H17-Br-O5

Molecular Weight

  • 393.2313
 
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Names and Synonyms

Synonyms

  • alpha-(2-(6-Bromo-1,3-benzodioxol-5-yl)ethenyl)-2,5-dimethoxybenzenemethanol
  • D 625

Systematic Name

  • Benzenemethanol, alpha-(2-(6-bromo-1,3-benzodioxol-5-yl)ethenyl)-2,5-dimethoxy-

Registry Numbers

CAS Registry Number

  • 58345-01-0

System Generated Number

  • 0058345010

Structure Descriptors

InChI

1S/C18H17BrO5/c1-21-12-4-6-16(22-2)13(8-12)15(20)5-3-11-7-17-18(9-14(11)19)24-10-23-17/h3-9,15,20H,10H2,1-2H3/b5-3+

InChIKey

CIJMACSTFFCMJN-HWKANZROSA-N

Smiles

COc1ccc(c(c1)C(/C=C/c2cc3c(cc2Br)OCO3)O)OC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal > 2gm/kg (2000mg/kg)   French Demande Patent Document. Vol. #2253503,