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Substance Name: Valeric acid, 5-(dimethylamino)-2,2-diphenyl-, sulfate (1:1)
RN: 10404-39-4
InChIKey: AKGRXOUIEANRSV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H23-N-O2.H2-S-O4

Molecular Weight

  • 395.474
 
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Names and Synonyms

Synonyms

  • 5-(Dimethylamino)-2,2-diphenylvaleric acid sulfate
  • alpha-(3-Dimethylaminopropyl)diphenylacetic acid sulfate
  • Pentanoic acid, 5-(dimethylamino)-2,2-diphenyl-, sulfate (1:1)

Systematic Name

  • Valeric acid, 5-(dimethylamino)-2,2-diphenyl-, sulfate (1:1)

Registry Numbers

CAS Registry Number

  • 10404-39-4

System Generated Number

  • 0010404394

Molecular Formulas

Molecular Formula

  • C19-H23-N-O2.H2-S-O4

Molecular Formula Fragments

  • C19-H23-N-O2
  • COMPONENT
  • H2-S-O4

Structure Descriptors

InChI

1S/C19H23NO2.H2O4S/c1-20(2)15-9-14-19(18(21)22,16-10-5-3-6-11-16)17-12-7-4-8-13-17;1-5(2,3)4/h3-8,10-13H,9,14-15H2,1-2H3,(H,21,22);(H2,1,2,3,4)

InChIKey

AKGRXOUIEANRSV-UHFFFAOYSA-N

Smiles

C(C(c1ccccc1)(c1ccccc1)CCCN(C)C)(=O)O.S(=O)(=O)(O)O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 290mg/kg (290mg/kg)   Journal of Medicinal Chemistry. Vol. 9, Pg. 786, 1966.