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Substance Name: 3-Heptanol, 6-(N,N-dimethylamino)-4,4-diphenyl-, propionate, hydrochloride
RN: 63848-89-5
InChIKey: MARGMYHNEQURTE-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C24-H33-N-O2.Cl-H

Molecular Weight

  • 403.991
 
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Names and Synonyms

Synonym

  • 3-Propionoxy-6-dimethylamino-4,4-diphenyl heptane hydrochloride

Systematic Name

  • 3-Heptanol, 6-(N,N-dimethylamino)-4,4-diphenyl-, propionate, hydrochloride

Registry Numbers

CAS Registry Number

  • 63848-89-5

System Generated Number

  • 0063848895

Molecular Formulas

Molecular Formula

  • C24-H33-N-O2.Cl-H

Molecular Formula Fragments

  • C24-H33-N-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C24H33NO2.ClH/c1-6-22(27-23(26)7-2)24(18-19(3)25(4)5,20-14-10-8-11-15-20)21-16-12-9-13-17-21;/h8-17,19,22H,6-7,18H2,1-5H3;1H

InChIKey

MARGMYHNEQURTE-UHFFFAOYSA-N

Smiles

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

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 35mg/kg (35mg/kg)   Journal of the American Chemical Society. Vol. 71, Pg. 57, 1949.
mouse LD50 subcutaneous 250mg/kg (250mg/kg) BEHAVIORAL: CHANGES IN MOTOR ACTIVITY (SPECIFIC ASSAY) Journal of Pharmacology and Experimental Therapeutics. Vol. 98, Pg. 121, 1950.