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Substance Name: 3-Heptanol, 7-(dimethylamino)-4,4-diphenyl-, hydrochloride
RN: 67227-09-2
InChIKey: UKSUEHCHLRIILI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C21-H29-N-O.Cl-H

Molecular Weight

  • 347.927
 
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Names and Synonyms

Synonym

  • 7-(Dimethylamino)-4,4-diphenyl-3-heptanol hydrochloride

Systematic Name

  • 3-Heptanol, 7-(dimethylamino)-4,4-diphenyl-, hydrochloride

Registry Numbers

CAS Registry Number

  • 67227-09-2

System Generated Number

  • 0067227092

Molecular Formulas

Molecular Formula

  • C21-H29-N-O.Cl-H

Molecular Formula Fragments

  • C21-H29-N-O
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C21H29NO.ClH/c1-4-20(23)21(16-11-17-22(2)3,18-12-7-5-8-13-18)19-14-9-6-10-15-19;/h5-10,12-15,20,23H,4,11,16-17H2,1-3H3;1H

InChIKey

UKSUEHCHLRIILI-UHFFFAOYSA-N

Smiles

C(c1ccccc1)(c1ccccc1)(CCC[NH+](C)C)[C@@H](CC)O.[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 185mg/kg (185mg/kg)   Journal of the American Chemical Society. Vol. 71, Pg. 57, 1949.