Home Sulfos 1-(2-fluorophenyl)-2-methanesulfonylethan-1-one

1-(2-fluorophenyl)-2-methanesulfonylethan-1-one

CAS No.:
1249532-55-5
Catalog Number:
AG01AIGU
Molecular Formula:
C9H9FO3S
Molecular Weight:
216.2294
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Product Description
Catalog Number:
AG01AIGU
Chemical Name:
1-(2-fluorophenyl)-2-methanesulfonylethan-1-one
CAS Number:
1249532-55-5
Molecular Formula:
C9H9FO3S
Molecular Weight:
216.2294
MDL Number:
MFCD16860246
IUPAC Name:
1-(2-fluorophenyl)-2-methylsulfonylethanone
InChI:
InChI=1S/C9H9FO3S/c1-14(12,13)6-9(11)7-4-2-3-5-8(7)10/h2-5H,6H2,1H3
InChI Key:
OZAXUXKXKMZWPB-UHFFFAOYSA-N
SMILES:
O=C(c1ccccc1F)CS(=O)(=O)C
Properties
Complexity:
305  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
216.026g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
216.226g/mol
Monoisotopic Mass:
216.026g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
59.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.1  
Properties