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Substance Name: Cyclohexaneacetic acid, 1-hydroxy-alpha-phenyl-, (2-(diethylamino)ethyl) ester
RN: 102371-04-0
InChIKey: KTWQAWSQSOISLN-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H31-N-O3

Molecular Weight

  • 333.4689
 
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Names and Synonyms

Synonyms

  • 1-Hydroxy-alpha-phenylcyclohexaneacetic acid (2-(diethylamino)ethyl) ester
  • 4-10-00-01070 (Beilstein Handbook Reference)
  • BRN 2668897
  • Oxy-cyclohexyl-phenyl-essigsaeure-diaethylaminoaethyl-ester
  • Oxy-cyclohexyl-phenyl-essigsaeure-diaethylaminoaethyl-ester [German]

Systematic Name

  • Cyclohexaneacetic acid, 1-hydroxy-alpha-phenyl-, (2-(diethylamino)ethyl) ester

Registry Numbers

CAS Registry Number

  • 102371-04-0

System Generated Number

  • 0102371040

Structure Descriptors

InChI

1S/C20H31NO3/c1-3-21(4-2)15-16-24-19(22)18(17-11-7-5-8-12-17)20(23)13-9-6-10-14-20/h5,7-8,11-12,18,23H,3-4,6,9-10,13-16H2,1-2H3

InChIKey

KTWQAWSQSOISLN-UHFFFAOYSA-N

Smiles

CCN(CC)CCOC(=O)C(c1ccccc1)C2(CCCCC2)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 65mg/kg (65mg/kg)   Naunyn-Schmiedeberg's Archiv fuer Experimentelle Pathologie und Pharmakologie. Vol. 226, Pg. 18, 1955.
mouse LD50 subcutaneous 320mg/kg (320mg/kg)   Naunyn-Schmiedeberg's Archiv fuer Experimentelle Pathologie und Pharmakologie. Vol. 226, Pg. 18, 1955.