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Substance Name: 2-Propen-1-one, 1-(5-acetyl-2,4-dihydroxyphenyl)-3-(2-hydroxyphenyl)-
RN: 108051-25-8
InChIKey: MZJNPFBIAPPQDR-VOTSOKGWSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H14-O5

Molecular Weight

  • 298.2926
 
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Names and Synonyms

Synonyms

  • 1-(5-Acetyl-2,4-dihydroxyphenyl)-3-(2-hydroxyphenyl)-2-propen-1-one
  • Acrylophenone, 5'-acetyl-2',4'-dihydroxy-3-(o-hydroxyphenyl)-
  • BRN 5581996

Systematic Name

  • 2-Propen-1-one, 1-(5-acetyl-2,4-dihydroxyphenyl)-3-(2-hydroxyphenyl)-

Registry Numbers

CAS Registry Number

  • 108051-25-8

System Generated Number

  • 0108051258

Structure Descriptors

InChI

1S/C17H14O5/c1-10(18)12-8-13(17(22)9-16(12)21)15(20)7-6-11-4-2-3-5-14(11)19/h2-9,19,21-22H,1H3/b7-6+

InChIKey

MZJNPFBIAPPQDR-VOTSOKGWSA-N

Smiles

CC(=O)c1cc(c(cc1O)O)C(=O)/C=C/c2ccccc2O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 unreported 650mg/kg (650mg/kg)   Pharmaceutical Chemistry Journal Vol. 20, Pg. 406, 1986.