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Substance Name: Phenethylamine, 2-chloro-alpha,alpha-dimethyl-4-dimethylamino-, dihydrochloride, hydrate
RN: 74051-04-0
InChIKey: MDAWVMUNHMQABP-UHFFFAOYSA-N

Molecular Formula

  • C12-H19-Cl-N2.2Cl-H.H2-O

Molecular Weight

  • 317.6857
 
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Names and Synonyms

Synonym

  • 2-Chloro-alpha,alpha-dimethyl-4-dimethylaminophenethylamine dihydrochloride hydrate

Systematic Name

  • Phenethylamine, 2-chloro-alpha,alpha-dimethyl-4-dimethylamino-, dihydrochloride, hydrate

Registry Numbers

CAS Registry Number

  • 74051-04-0

System Generated Number

  • 0074051040

Molecular Formulas

Molecular Formula

  • C12-H19-Cl-N2.2Cl-H.H2-O

Molecular Formula Fragments

  • C12-H19-Cl-N2
  • Cl-H
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C12H19ClN2.2ClH.H2O/c1-12(2,14)8-9-5-6-10(15(3)4)7-11(9)13;;;/h5-7H,8,14H2,1-4H3;2*1H;1H2

InChIKey

MDAWVMUNHMQABP-UHFFFAOYSA-N

Smiles

CC(C)(Cc1ccc(cc1Cl)N(C)C)N.O.Cl.Cl

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 159mg/kg (159mg/kg)   Journal of Medicinal Chemistry. Vol. 21, Pg. 56, 1978.