Nombre: ethyl 3-chloro-4-(chlorosulfonyl)benzoate
SMILES:
CCOC(=O)c1ccc(S(=O)(=O)Cl)c(Cl)c1Molecular Processing
Molecular formula
C9H8Cl2O4S
Molecular weight
283.13
Exact mass
281.952
XLogP
2.44
TPSA
60.44
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
16
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
0.222
Molar refractivity
60.45
Supplementary Information
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