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Substance Name: 2-Propen-1-one, 1-(5-acetyl-2,4-dihydroxyphenyl)-3-phenyl-
RN: 108051-24-7
InChIKey: KIHJTLCIXKUDAB-BQYQJAHWSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C17-H14-O4

Molecular Weight

  • 282.2936
 
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Names and Synonyms

Synonyms

  • 1-(5-Acetyl-2,4-dihydroxyphenyl)-3-phenyl-2-propen-1-one
  • Acrylophenone, 5'-acetyl-2',4'-dihydroxy-3-phenyl-

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 108051-24-7

System Generated Number

  • 0108051247

Structure Descriptors

InChI

1S/C17H14O4/c1-11(18)13-9-14(17(21)10-16(13)20)15(19)8-7-12-5-3-2-4-6-12/h2-10,20-21H,1H3/b8-7+

InChIKey

KIHJTLCIXKUDAB-BQYQJAHWSA-N

Smiles

CC(=O)c1cc(c(cc1O)O)C(=O)/C=C/c2ccccc2

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.