COc1ccc(C(N)=O)cc1S(=O)(=O)Cl
Name: 5-Carbamoyl-2-methoxybenzenesulfonyl chloride
SMILES: COc1ccc(C(N)=O)cc1S(=O)(=O)Cl

Molecular Processing

Molecular formula
C8H8ClNO4S
Molecular weight
249.68
Exact mass
248.9863
XLogP
0.72
TPSA
86.46
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
15
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
54.55

Supplementary Information

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