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Substance Name: 1-Penten-3-one, 4,4-dimethyl-1-(2-methoxy-4,5-methylenedioxyphenyl)-
RN: 58344-83-5
InChIKey: TXELCICVIOTPKC-AATRIKPKSA-N

Molecular Formula

  • C15-H18-O4

Molecular Weight

  • 262.3032
 
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Names and Synonyms

Synonyms

  • 4,4-Dimethyl-1-(2-methoxy-4,5-methylenedioxyphenyl)-1-penten-3-one
  • BRN 1381788

Systematic Name

  • 1-Penten-3-one, 4,4-dimethyl-1-(2-methoxy-4,5-methylenedioxyphenyl)-

Registry Numbers

CAS Registry Number

  • 58344-83-5

System Generated Number

  • 0058344835

Structure Descriptors

InChI

1S/C15H18O4/c1-15(2,3)14(16)6-5-10-7-12-13(19-9-18-12)8-11(10)17-4/h5-8H,9H2,1-4H3/b6-5+

InChIKey

TXELCICVIOTPKC-AATRIKPKSA-N

Smiles

CC(C)(C)C(=O)/C=C/c1cc2c(cc1OC)OCO2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 2gm/kg (2000mg/kg)   European Journal of Medicinal Chemistry--Chimie Therapeutique. Vol. 13, Pg. 41, 1978.