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Substance Name: Propiophenone, 3',4'-dihydroxy-
RN: 7451-98-1
InChIKey: HNWIHBDMOYWCGX-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C9-H10-O3

Molecular Weight

  • 166.175
 
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Names and Synonyms

Synonyms

  • 1-Propanone, 1-(3,4-dihydroxyphenyl)-
  • 3',4'-Dihydroxypropiophenone
  • NSC 63842
  • Propiophenone, 3',4'-dihydroxy-

Systematic Names

  • 1-Propanone, 1-(3,4-dihydroxyphenyl)- (9CI)
  • Propiophenone, 3',4'-dihydroxy-

Registry Numbers

CAS Registry Number

  • 7451-98-1

System Generated Number

  • 0007451981

Structure Descriptors

InChI

1S/C9H10O3/c1-2-7(10)6-3-4-8(11)9(12)5-6/h3-5,11-12H,2H2,1H3

InChIKey

HNWIHBDMOYWCGX-UHFFFAOYSA-N

Smiles

c1(cc(O)c(cc1)O)C(=O)CC

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 650mg/kg (650mg/kg) BEHAVIORAL: ALTERED SLEEP TIME (INCLUDING CHANGE IN RIGHTING REFLEX) Journal of Medicinal Chemistry. Vol. 7, Pg. 178, 1964.
mouse LD50 oral 760mg/kg (760mg/kg)   Pharmaceutical Chemistry Journal Vol. 23, Pg. 990, 1989.