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Home Other Building Blocks N-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide hydrochloride

N-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide hydrochloride

CAS No.:
1458384-01-4
Catalog Number:
AG01BG1M
Molecular Formula:
C12H15ClF3N3O
Molecular Weight:
309.7152
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Product Description
Catalog Number:
AG01BG1M
Chemical Name:
N-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide hydrochloride
CAS Number:
1458384-01-4
Molecular Formula:
C12H15ClF3N3O
Molecular Weight:
309.7152
MDL Number:
MFCD28118800
IUPAC Name:
N-[3-(trifluoromethyl)phenyl]piperazine-1-carboxamide;hydrochloride
InChI:
InChI=1S/C12H14F3N3O.ClH/c13-12(14,15)9-2-1-3-10(8-9)17-11(19)18-6-4-16-5-7-18;/h1-3,8,16H,4-7H2,(H,17,19);1H
InChI Key:
QSYJHECVMKRKSN-UHFFFAOYSA-N
SMILES:
O=C(N1CCNCC1)Nc1cccc(c1)C(F)(F)F.Cl
Properties
Complexity:
316  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
309.086g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
309.717g/mol
Monoisotopic Mass:
309.086g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
44.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties