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Substance Name: Oxyclipine [INN]
RN: 4354-45-4
UNII: OP853VBF2G
InChIKey: LCFBCKSQWVQIBY-QSVWIEALSA-N

Molecular Formula

  • C20-H29-N-O3

Molecular Weight

  • 331.4531
 
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Names and Synonyms

Results Name

  • Oxyclipine [INN]

Name of Substance

  • Oxyclipine [INN]
  • Propenzolate

Synonyms

  • 1-Methyl-3-piperidyl (+-)-alpha-phenylcyclohexane-glycolate
  • 1-Methyl-3-piperidyl alpha-cyclohexylmandelat
  • 1-Methyl-3-piperidyl alpha-phenylcyclohexaneglycolate
  • 3-Piperidinol, 1-methyl-, alpha-phenylcyclohexaneglycolate (ester)
  • BRN 1437277
  • JB 840
  • N-Methyl-3-piperidyl-alpha-cyclohexyl mandelate
  • Oxiclipina
  • Oxiclipina [INN-Spanish]
  • Oxiclipinum
  • Oxyclipine
  • Oxyclipinum
  • Oxyclipinum [INN-Latin]
  • Propenzolate
  • UNII-OP853VBF2G

Systematic Names

  • Benzeneacetic acid, alpha-cyclohexyl-alpha-hydroxy-, 1-methyl-3-piperidinyl ester
  • Cyclohexaneglycolic acid, alpha-phenyl-, 1-methyl-3-piperidyl ester

Registry Numbers

CAS Registry Number

  • 4354-45-4

FDA UNII

  • OP853VBF2G

System Generated Number

  • 0004354454

Structure Descriptors

InChI

1S/C20H29NO3/c1-21-14-8-13-18(15-21)24-19(22)20(23,16-9-4-2-5-10-16)17-11-6-3-7-12-17/h2,4-5,9-10,17-18,23H,3,6-8,11-15H2,1H3/t18-,20?/m1/s1

InChIKey

LCFBCKSQWVQIBY-QSVWIEALSA-N

Smiles

CN1CCC[C@H](C1)OC(=O)C(O)(C2CCCCC2)c3ccccc3

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 32mg/kg (32mg/kg) BEHAVIORAL: ATAXIA

BEHAVIORAL: MUSCLE WEAKNESS

CARDIAC: PULSE RATE INCREASE WITHOUT FALL IN BP
Archives Internationales de Pharmacodynamie et de Therapie. Vol. 120, Pg. 186, 1959.
rat LD50 intravenous 18mg/kg (18mg/kg) BEHAVIORAL: ATAXIA

BEHAVIORAL: MUSCLE WEAKNESS

CARDIAC: PULSE RATE INCREASE WITHOUT FALL IN BP
Archives Internationales de Pharmacodynamie et de Therapie. Vol. 120, Pg. 186, 1959.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 3.510 (none)   EST
Atmospheric OH Rate Constant 1.19E-10 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.