Home Sulfos [3-chloro-5-(ethanesulfonyl)phenyl]methanamine

[3-chloro-5-(ethanesulfonyl)phenyl]methanamine

CAS No.:
1565935-59-2
Catalog Number:
AG01C2WS
Molecular Formula:
C9H12ClNO2S
Molecular Weight:
233.7151
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Product Description
Catalog Number:
AG01C2WS
Chemical Name:
[3-chloro-5-(ethanesulfonyl)phenyl]methanamine
CAS Number:
1565935-59-2
Molecular Formula:
C9H12ClNO2S
Molecular Weight:
233.7151
MDL Number:
MFCD26051444
IUPAC Name:
(3-chloro-5-ethylsulfonylphenyl)methanamine
InChI:
InChI=1S/C9H12ClNO2S/c1-2-14(12,13)9-4-7(6-11)3-8(10)5-9/h3-5H,2,6,11H2,1H3
InChI Key:
FBECWLSEXGYBDK-UHFFFAOYSA-N
SMILES:
NCc1cc(Cl)cc(c1)S(=O)(=O)CC
Properties
Complexity:
273  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
233.028g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
233.71g/mol
Monoisotopic Mass:
233.028g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
68.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties