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Substance Name: 2-Propanol, 1-(bis(2-methylpropyl)amino)-3-(diethylamino)-, benzoate (ester), dihydrochloride
RN: 51734-37-3
InChIKey: KGGIFQOTGCPQAV-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C22-H38-N2-O2.2Cl-H

Molecular Weight

  • 435.476
 
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Names and Synonyms

Synonyms

  • 1-(Bis(2-methylpropyl)amino)-3-(diethylamino)-2-propanol benzoate (ester) dihydrochloride
  • 1-Diethylamino-3-(diisobutylamino)-2-propanol benzoate dihydrochloride

Systematic Name

  • 2-Propanol, 1-(bis(2-methylpropyl)amino)-3-(diethylamino)-, benzoate (ester), dihydrochloride

Registry Numbers

CAS Registry Number

  • 51734-37-3

System Generated Number

  • 0051734373

Molecular Formulas

Molecular Formula

  • C22-H38-N2-O2.2Cl-H

Molecular Formula Fragments

  • C22-H38-N2-O2
  • Cl-H
  • COMPONENT

Structure Descriptors

InChI

1S/C22H38N2O2.2ClH/c1-7-23(8-2)16-21(17-24(14-18(3)4)15-19(5)6)26-22(25)20-12-10-9-11-13-20;;/h9-13,18-19,21H,7-8,14-17H2,1-6H3;2*1H

InChIKey

KGGIFQOTGCPQAV-UHFFFAOYSA-N

Smiles

CCN(CC)CC(CN(CC(C)C)CC(C)C)OC(=O)c1ccccc1.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD subcutaneous > 200mg/kg (200mg/kg)   Yakugaku Zasshi. Journal of Pharmacy. Vol. 94, Pg. 126, 1974.