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Substance Name: 1-Benzazocine-1-ethylamine, 1,2,3,4,5,6-hexahydro-, acetate
RN: 100310-99-4
InChIKey: HQGBJQUVQHPPIQ-UHFFFAOYSA-N

Molecular Formula

  • C13-H20-N2.C2-H4-O2

Molecular Weight

  • 264.3666
 
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Names and Synonyms

Synonyms

  • 1,2,3,4,5,6-Hexahydro-1-benzazocine-1-ethylamine acetate
  • N-(2-Aminoethyl)-1,2,3,4,5,6-hexahydro-1-benzazocine acetate salt

Systematic Name

  • 1-Benzazocine-1-ethylamine, 1,2,3,4,5,6-hexahydro-, acetate

Registry Numbers

CAS Registry Number

  • 100310-99-4

System Generated Number

  • 0100310994

Molecular Formulas

Molecular Formula

  • C13-H20-N2.C2-H4-O2

Molecular Formula Fragments

  • C13-H20-N2
  • C2-H4-O2
  • COMPONENT

Structure Descriptors

InChI

1S/C13H20N2.C2H4O2/c14-9-11-15-10-5-1-2-6-12-7-3-4-8-13(12)15;1-2(3)4/h3-4,7-8H,1-2,5-6,9-11,14H2;1H3,(H,3,4)

InChIKey

HQGBJQUVQHPPIQ-UHFFFAOYSA-N

Smiles

CC(=O)O.c1ccc2c(c1)CCCCCN2CCN

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intravenous 24mg/kg (24mg/kg)   U.S. Army Armament Research & Development Command, Chemical Systems Laboratory, NIOSH Exchange Chemicals. Vol. NX#08184,