Home Sulfos 3-(aminomethyl)-N-(2,2,2-trifluoroethyl)benzene-1-sulfonamide hydrochloride

3-(aminomethyl)-N-(2,2,2-trifluoroethyl)benzene-1-sulfonamide hydrochloride

CAS No.:
1820716-71-9
Catalog Number:
AG01AN2K
Molecular Formula:
C9H12ClF3N2O2S
Molecular Weight:
304.7170
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Product Description
Catalog Number:
AG01AN2K
Chemical Name:
3-(aminomethyl)-N-(2,2,2-trifluoroethyl)benzene-1-sulfonamide hydrochloride
CAS Number:
1820716-71-9
Molecular Formula:
C9H12ClF3N2O2S
Molecular Weight:
304.7170
MDL Number:
MFCD29034122
IUPAC Name:
3-(aminomethyl)-N-(2,2,2-trifluoroethyl)benzenesulfonamide;hydrochloride
InChI:
InChI=1S/C9H11F3N2O2S.ClH/c10-9(11,12)6-14-17(15,16)8-3-1-2-7(4-8)5-13;/h1-4,14H,5-6,13H2;1H
InChI Key:
MBGQKGHUOYFPCR-UHFFFAOYSA-N
SMILES:
NCc1cccc(c1)S(=O)(=O)NCC(F)(F)F.Cl
Properties
Complexity:
337  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
2  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
304.026g/mol
Formal Charge:
0
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
3  
Isotope Atom Count:
0
Molecular Weight:
304.712g/mol
Monoisotopic Mass:
304.026g/mol
Rotatable Bond Count:
4  
Topological Polar Surface Area:
80.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties