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1233955-86-6 | N-(4-Chlorobenzyl)piperidine-4-amine dihydrochloride
CAS No: 1233955-86-6 Catalog No: AG01F8FK MDL No:
Product Description
Catalog Number:
AG01F8FK
Chemical Name:
N-(4-Chlorobenzyl)piperidine-4-amine dihydrochloride
CAS Number:
1233955-86-6
Molecular Formula:
C12H19Cl3N2
Molecular Weight:
297.6517
IUPAC Name:
N-[(4-chlorophenyl)methyl]piperidin-4-amine;dihydrochloride
InChI:
InChI=1S/C12H17ClN2.2ClH/c13-11-3-1-10(2-4-11)9-15-12-5-7-14-8-6-12;;/h1-4,12,14-15H,5-9H2;2*1H
InChI Key:
OXOBEYDZDSRWMP-UHFFFAOYSA-N
SMILES:
Clc1ccc(cc1)CNC1CCNCC1.Cl.Cl
Properties
Complexity:
173
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
3
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
296.061g/mol
Formal Charge:
0
Heavy Atom Count:
17
Hydrogen Bond Acceptor Count:
2
Hydrogen Bond Donor Count:
4
Isotope Atom Count:
0
Molecular Weight:
297.648g/mol
Monoisotopic Mass:
296.061g/mol
Rotatable Bond Count:
3
Topological Polar Surface Area:
24.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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