Home Sulfos 1-(3-chloro-4-fluorobenzenesulfonyl)piperazine hydrochloride

1-(3-chloro-4-fluorobenzenesulfonyl)piperazine hydrochloride

CAS No.:
1251923-60-0
Catalog Number:
AG01AA32
Molecular Formula:
C10H13Cl2FN2O2S
Molecular Weight:
315.1918
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Product Description
Catalog Number:
AG01AA32
Chemical Name:
1-(3-chloro-4-fluorobenzenesulfonyl)piperazine hydrochloride
CAS Number:
1251923-60-0
Molecular Formula:
C10H13Cl2FN2O2S
Molecular Weight:
315.1918
MDL Number:
MFCD16817551
IUPAC Name:
1-(3-chloro-4-fluorophenyl)sulfonylpiperazine;hydrochloride
InChI:
InChI=1S/C10H12ClFN2O2S.ClH/c11-9-7-8(1-2-10(9)12)17(15,16)14-5-3-13-4-6-14;/h1-2,7,13H,3-6H2;1H
InChI Key:
VXGUHJAVSCUSDM-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1Cl)S(=O)(=O)N1CCNCC1.Cl
Properties
Complexity:
354  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
314.006g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
315.184g/mol
Monoisotopic Mass:
314.006g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
57.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties