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Substance Name: Acetophenone, 3',4'-dihydroxy-2-(1-pyrrolidinyl)-
RN: 16899-82-4
InChIKey: KSZQAZXCZAHBPB-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H15-N-O3

Molecular Weight

  • 221.255
 
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Names and Synonyms

Synonyms

  • 1-(3,4-Dihydroxyphenyl)-2-(1-pyrrolidinyl)ethanone
  • 3',4'-Dihydroxy-2-(1-pyrrolidinyl)acetophenone
  • 4-20-00-00184 (Beilstein Handbook Reference)
  • BRN 0176968
  • U 2956

Systematic Names

  • Acetophenone, 3',4'-dihydroxy-2-(1-pyrrolidinyl)-
  • Ethanone, 1-(3,4-dihydroxyphenyl)-2-(1-pyrrolidinyl)- (9CI)

Registry Numbers

CAS Registry Number

  • 16899-82-4

System Generated Number

  • 0016899824

Structure Descriptors

InChI

1S/C12H15NO3/c14-10-4-3-9(7-11(10)15)12(16)8-13-5-1-2-6-13/h3-4,7,14-15H,1-2,5-6,8H2

InChIKey

KSZQAZXCZAHBPB-UHFFFAOYSA-N

Smiles

c1(C(CN2CCCC2)=O)cc(c(O)cc1)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 39mg/kg (39mg/kg)   Naunyn-Schmiedeberg's Archiv fuer Experimentelle Pathologie und Pharmakologie. Vol. 226, Pg. 493, 1955.