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Substance Name: 1-Penten-3-ol, 4,4-dimethyl-1-(2,4,5-trimethoxyphenyl)-
RN: 58344-48-2
InChIKey: XYNNXBRGINAKIT-BQYQJAHWSA-N

Molecular Formula

  • C16-H24-O4

Molecular Weight

  • 280.3616
 
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Names and Synonyms

Synonyms

  • 4,4-Dimethyl-1-(2,4,5-trimethoxyphenyl)-1-penten-3-ol
  • BRN 2282487

Systematic Name

  • 1-Penten-3-ol, 4,4-dimethyl-1-(2,4,5-trimethoxyphenyl)-

Registry Numbers

CAS Registry Number

  • 58344-48-2

System Generated Number

  • 0058344482

Structure Descriptors

InChI

1S/C16H24O4/c1-16(2,3)15(17)8-7-11-9-13(19-5)14(20-6)10-12(11)18-4/h7-10,15,17H,1-6H3/b8-7+

InChIKey

XYNNXBRGINAKIT-BQYQJAHWSA-N

Smiles

CC(C)(C)C(/C=C/c1cc(c(cc1OC)OC)OC)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.