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Substance Name: 1-Naphthaleneethylamine, beta-(2-butenyl)-N-(2-morpholinoethyl)-, dihydrochloride, hemihydrat
RN: 73826-59-2
InChIKey: KXMSLGXAAWGIHB-WTVBWJGASA-N

Molecular Formula

  • C22-H30-N-O.2Cl-H.1/2H2-O

Molecular Weight

  • 411.414
 
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Names and Synonyms

Synonyms

  • 4-Hexenylamine, N-(2-morpholinoethyl)-2-(1-naphthyl)-, dihydrochloride, hemihydrate
  • beta-(2-Butenyl)-N-(2-morpholinoethyl)-1-naphthaleneethylamine dihydrochloride hemihydrate

Systematic Name

  • 1-Naphthaleneethylamine, beta-(2-butenyl)-N-(2-morpholinoethyl)-, dihydrochloride, hemihydrat

Registry Numbers

CAS Registry Number

  • 73826-59-2

System Generated Number

  • 0073826592

Molecular Formulas

Molecular Formula

  • C22-H30-N-O.2Cl-H.1/2H2-O

Molecular Formula Fragments

  • C22-H30-N-O
  • Cl-H
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C22H30N2O.2ClH/c1-2-3-7-20(18-23-12-13-24-14-16-25-17-15-24)22-11-6-9-19-8-4-5-10-21(19)22;;/h2-6,8-11,20,23H,7,12-18H2,1H3;2*1H/b3-2+;;

InChIKey

KXMSLGXAAWGIHB-WTVBWJGASA-N

Smiles

c1(c2c(ccc1)cccc2)[C@@H](C[NH2+]CC[NH+]1CCOCC1)C\C=C\C.[ClH-].[ClH-]

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 27mg/kg (27mg/kg)   Chimica Therapeutica. Vol. 3, Pg. 121, 1968.