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Substance Name: 2-Propen-1-one, 1-(5-acetyl-2,4-dihydroxyphenyl)-3-(4-(dimethylamino)phenyl)-
RN: 108051-30-5
InChIKey: KALMLYSSIUEYFC-RMKNXTFCSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H19-N-O4

Molecular Weight

  • 325.3621
 
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Names and Synonyms

Synonyms

  • 1-(5-Acetyl-2,4-dihydroxyphenyl)-3-(4-(dimethylamino)phenyl)-2-propen-1-one
  • Acrylophenone, 5'-acetyl-2',4'-dihydroxy-3-(p-(dimethylamino)phenyl)-
  • BRN 5590066

Systematic Name

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

Registry Numbers

CAS Registry Number

  • 108051-30-5

System Generated Number

  • 0108051305

Structure Descriptors

InChI

1S/C19H19NO4/c1-12(21)15-10-16(19(24)11-18(15)23)17(22)9-6-13-4-7-14(8-5-13)20(2)3/h4-11,23-24H,1-3H3/b9-6+

InChIKey

KALMLYSSIUEYFC-RMKNXTFCSA-N

Smiles

CC(=O)c1cc(c(cc1O)O)C(=O)/C=C/c2ccc(cc2)N(C)C

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mammal (species unspecified) LD50 unreported 850mg/kg (850mg/kg)   Pharmaceutical Chemistry Journal Vol. 20, Pg. 406, 1986.