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Substance Name: Benzhydrol, alpha-(2-(isopropylmethyl)amino-1-methylethyl)-, hydrobromide
RN: 14326-24-0
InChIKey: SXTGACHOYYCQIT-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H27-N-O.Br-H

Molecular Weight

  • 378.351
 
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Names and Synonyms

Synonyms

  • 1,1-Diphenyl-2-methyl-3-(isopropylmethylamino)propanol hydrobromide
  • alpha-(2-(Isopropylmethyl)amino-1-methylethyl)benzhydrol hydrobromide

Systematic Name

  • Benzhydrol, alpha-(2-(isopropylmethyl)amino-1-methylethyl)-, hydrobromide

Registry Numbers

CAS Registry Number

  • 14326-24-0

System Generated Number

  • 0014326240

Molecular Formulas

Molecular Formula

  • C20-H27-N-O.Br-H

Molecular Formula Fragments

  • Br-H
  • C20-H27-N-O
  • COMPONENT

Structure Descriptors

InChI

1S/C20H27NO.BrH/c1-16(2)21(4)15-17(3)20(22,18-11-7-5-8-12-18)19-13-9-6-10-14-19;/h5-14,16-17,22H,15H2,1-4H3;1H

InChIKey

SXTGACHOYYCQIT-UHFFFAOYSA-N

Smiles

c1(ccccc1)C(O)(c1ccccc1)[C@@H](C[N@@](C(C)C)C)C.Br

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 178mg/kg (178mg/kg)   Journal of Medicinal Chemistry. Vol. 14, Pg. 1106, 1971.