Name: 3-[(4-fluorophenyl)sulfonyl]propanoic acid
SMILES:
O=C(O)CCS(=O)(=O)c1ccc(F)cc1Molecular Processing
Molecular formula
C9H9FO4S
Molecular weight
232.23
Exact mass
232.0206
XLogP
1.07
TPSA
71.44
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
15
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
50.71
Supplementary Information
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