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Substance Name: Acetic acid, 2-cyclohexyl-2-phenyl-, (2,2-dimethyl-3-morpholinopropyl) ester, hydrochloride
RN: 66827-40-5
InChIKey: VDJOYMWJYWFIRW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H35-N-O3.Cl-H

Molecular Weight

  • 409.994
 
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Names and Synonyms

Synonyms

  • 2-Cyclohexyl-2-phenylacetic acid (2,2-dimethyl-3-morpholinopropyl) ester hydrochloride
  • Acetic acid, cyclohexylphenyl-, 2,2-dimethyl-3-(4-morpholinyl)propyl ester, hydrochloride
  • beta,beta-Dimethyl-gamma-4-morpholinepropylphenylcyclohexaneacetate hydrochloride

Systematic Name

  • Acetic acid, 2-cyclohexyl-2-phenyl-, (2,2-dimethyl-3-morpholinopropyl) ester, hydrochloride

Registry Numbers

CAS Registry Number

  • 66827-40-5

System Generated Number

  • 0066827405

Molecular Formulas

Molecular Formula

  • C23-H35-N-O3.Cl-H

Molecular Formula Fragments

  • C23-H35-N-O3
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C23H35NO3.ClH/c1-23(2,17-24-13-15-26-16-14-24)18-27-22(25)21(19-9-5-3-6-10-19)20-11-7-4-8-12-20;/h3,5-6,9-10,20-21H,4,7-8,11-18H2,1-2H3;1H

InChIKey

VDJOYMWJYWFIRW-UHFFFAOYSA-N

Smiles

c1([C@@H](C2CCCCC2)C(OCC(C[NH+]2CCOCC2)(C)C)=O)ccccc1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 1500mg/kg (1500mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 82, Pg. 23, 1944.
rat LD50 intravenous 63mg/kg (63mg/kg)   Journal of Pharmacology and Experimental Therapeutics. Vol. 81, Pg. 174, 1944.