SMILES:
CN(CC(=O)O)S(=O)(=O)c1ccc2cc(Cl)ccc2c1Molecular Processing
Molecular formula
C13H12ClNO4S
Molecular weight
313.76
Exact mass
313.0176
XLogP
2.2
TPSA
74.68
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
20
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.154
Molar refractivity
76.41
Supplementary Information
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