Home Halogens 1-{[3-(chloromethyl)phenyl]methyl}piperidine hydrochloride

1-{[3-(chloromethyl)phenyl]methyl}piperidine hydrochloride

CAS No.:
104126-78-5
Catalog Number:
AG01C35Z
Molecular Formula:
C13H19Cl2N
Molecular Weight:
260.2027
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Product Description
Catalog Number:
AG01C35Z
Chemical Name:
1-{[3-(chloromethyl)phenyl]methyl}piperidine hydrochloride
CAS Number:
104126-78-5
Molecular Formula:
C13H19Cl2N
Molecular Weight:
260.2027
MDL Number:
MFCD29055220
IUPAC Name:
1-[[3-(chloromethyl)phenyl]methyl]piperidine;hydrochloride
InChI:
InChI=1S/C13H18ClN.ClH/c14-10-12-5-4-6-13(9-12)11-15-7-2-1-3-8-15;/h4-6,9H,1-3,7-8,10-11H2;1H
InChI Key:
NJQIJDKPDBYILY-UHFFFAOYSA-N
SMILES:
ClCc1cccc(c1)CN1CCCCC1.Cl
Properties
Complexity:
177  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
259.089g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
260.202g/mol
Monoisotopic Mass:
259.089g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
3.2A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties