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2-(3-Chlorobenzyl)azepane
[CAS# 68841-15-6]

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CAS#: 68841-15-6
Product: 2-(3-Chlorobenzyl)azepane
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Identification
Name 2-(3-Chlorobenzyl)azepane
Synonyms HEXAHYDRO-2-[(3-CHLOROPHENYL)METHYL]-1H-AZEPINE
Molecular Structure CAS#: 68841-15-6, 2-(3-Chlorobenzyl)azepane
Molecular Formula C13H18ClN
Molecular Weight 223.74
CAS Registry Number 68841-15-6
SMILES Clc1cccc(c1)CC2NCCCCC2
InChI 1S/C13H18ClN/c14-12-6-4-5-11(9-12)10-13-7-2-1-3-8-15-13/h4-6,9,13,15H,1-3,7-8,10H2
InChIKey XCYILRUWBQGYIA-UHFFFAOYSA-N
Properties
Density 1.063g/cm3 (Cal.)
Boiling point 316.989°C at 760 mmHg (Cal.)
Flash point 145.51°C (Cal.)
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