Home Sulfos 2-chloro-1-(4-(methylsulfonyl)phenyl)ethanone

2-chloro-1-(4-(methylsulfonyl)phenyl)ethanone

CAS No.:
99586-87-5
Catalog Number:
AG01DWY0
Molecular Formula:
C9H9ClO3S
Molecular Weight:
232.6840
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Product Description
Catalog Number:
AG01DWY0
Chemical Name:
2-chloro-1-(4-(methylsulfonyl)phenyl)ethanone
CAS Number:
99586-87-5
Molecular Formula:
C9H9ClO3S
Molecular Weight:
232.6840
MDL Number:
MFCD16093808
IUPAC Name:
2-chloro-1-(4-methylsulfonylphenyl)ethanone
InChI:
InChI=1S/C9H9ClO3S/c1-14(12,13)8-4-2-7(3-5-8)9(11)6-10/h2-5H,6H2,1H3
InChI Key:
AXIVKGQGCMDXMM-UHFFFAOYSA-N
SMILES:
ClCC(=O)c1ccc(cc1)S(=O)(=O)C
Properties
Complexity:
297  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
231.996g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
232.678g/mol
Monoisotopic Mass:
231.996g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
59.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.5  
Properties