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Substance Name: Benzylamine, N,N-dimethyl-alpha-(1,1-dimethyl-4-phenyl)butyl-, hydrochloride
RN: 4220-01-3
InChIKey: LLAOSTBDHPICKC-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H29-N.Cl-H

Molecular Weight

  • 331.928
 
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Names and Synonyms

Synonyms

  • 1,5-Diphenyl-2,2-dimethyl-1-dimethylaminopentane hydrochloride
  • N,N-Dimethyl-alpha-(1,1-dimethyl-4-phenyl)butylbenzylamine hydrochloride

Systematic Name

  • Benzylamine, N,N-dimethyl-alpha-(1,1-dimethyl-4-phenyl)butyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 4220-01-3

System Generated Number

  • 0004220013

Molecular Formulas

Molecular Formula

  • C21-H29-N.Cl-H

Molecular Formula Fragments

  • C21-H29-N
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C21H29N.ClH/c1-21(2,17-11-14-18-12-7-5-8-13-18)20(22(3)4)19-15-9-6-10-16-19;/h5-10,12-13,15-16,20H,11,14,17H2,1-4H3;1H

InChIKey

LLAOSTBDHPICKC-UHFFFAOYSA-N

Smiles

c1([C@@H](C(CCCc2ccccc2)(C)C)[NH+](C)C)ccccc1.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 950mg/kg (950mg/kg)   Journal of Medicinal Chemistry. Vol. 9, Pg. 187, 1966.