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Home Halogens N-(3-chloro-4-methylphenyl)piperazine-1-carboxamide hydrochloride

N-(3-chloro-4-methylphenyl)piperazine-1-carboxamide hydrochloride

CAS No.:
1172020-52-8
Catalog Number:
AG019V36
Molecular Formula:
C12H17Cl2N3O
Molecular Weight:
290.1889
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Product Description
Catalog Number:
AG019V36
Chemical Name:
N-(3-chloro-4-methylphenyl)piperazine-1-carboxamide hydrochloride
CAS Number:
1172020-52-8
Molecular Formula:
C12H17Cl2N3O
Molecular Weight:
290.1889
MDL Number:
MFCD11858111
IUPAC Name:
N-(3-chloro-4-methylphenyl)piperazine-1-carboxamide;hydrochloride
InChI:
InChI=1S/C12H16ClN3O.ClH/c1-9-2-3-10(8-11(9)13)15-12(17)16-6-4-14-5-7-16;/h2-3,8,14H,4-7H2,1H3,(H,15,17);1H
InChI Key:
FMNJZSKZUNKMAI-UHFFFAOYSA-N
SMILES:
O=C(N1CCNCC1)Nc1ccc(c(c1)Cl)C.Cl
Properties
Complexity:
269  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.075g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
290.188g/mol
Monoisotopic Mass:
289.075g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
44.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties