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Substance Name: 1-Pyrrolidineethanol, alpha-phenyl-, p-tert-butylbenzoate, hydrochloride
RN: 102762-28-7
InChIKey: RYUMRYJZXLAIBW-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C23-H29-N-O2.Cl-H

Molecular Weight

  • 387.948
 
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Names and Synonyms

Synonyms

  • alpha-Phenyl-1-pyrrolidineethanol p-tert-butylbenzoate hydrochloride
  • Benzoic acid, p-tert-butyl-, alpha-(1-pyrrolidinylmethyl)benzyl ester hydrochloride

Systematic Name

  • 1-Pyrrolidineethanol, alpha-phenyl-, p-tert-butylbenzoate, hydrochloride

Registry Numbers

CAS Registry Number

  • 102762-28-7

System Generated Number

  • 0102762287

Molecular Formulas

Molecular Formula

  • C23-H29-N-O2.Cl-H

Molecular Formula Fragments

  • C23-H29-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C23H29NO2.ClH/c1-23(2,3)20-13-11-19(12-14-20)22(25)26-21(17-24-15-7-8-16-24)18-9-5-4-6-10-18;/h4-6,9-14,21H,7-8,15-17H2,1-3H3;1H

InChIKey

RYUMRYJZXLAIBW-UHFFFAOYSA-N

Smiles

CC(C)(C)c1ccc(cc1)C(=O)OC(CN2CCCC2)c3ccccc3.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LDLo subcutaneous 400mg/kg (400mg/kg)   Journal of the American Chemical Society. Vol. 81, Pg. 203, 1959.