Home Halogens 1-[(4-chloro-2-methylphenyl)methyl]piperazine hydrochloride

1-[(4-chloro-2-methylphenyl)methyl]piperazine hydrochloride

CAS No.:
1803585-33-2
Catalog Number:
AG01BA1K
Molecular Formula:
C12H18Cl2N2
Molecular Weight:
261.1907
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Product Description
Catalog Number:
AG01BA1K
Chemical Name:
1-[(4-chloro-2-methylphenyl)methyl]piperazine hydrochloride
CAS Number:
1803585-33-2
Molecular Formula:
C12H18Cl2N2
Molecular Weight:
261.1907
MDL Number:
MFCD28397475
IUPAC Name:
1-[(4-chloro-2-methylphenyl)methyl]piperazine;hydrochloride
InChI:
InChI=1S/C12H17ClN2.ClH/c1-10-8-12(13)3-2-11(10)9-15-6-4-14-5-7-15;/h2-3,8,14H,4-7,9H2,1H3;1H
InChI Key:
HPTINTJLWITEDS-UHFFFAOYSA-N
SMILES:
Clc1ccc(c(c1)C)CN1CCNCC1.Cl
Properties
Complexity:
192  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
260.085g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
261.19g/mol
Monoisotopic Mass:
260.085g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
15.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties