Nombre: methyl-p-toluenesulfonate
SMILES:
COS(=O)(=O)c1ccc(C)cc1Molecular Processing
Molecular formula
C8H10O3S
Molecular weight
186.23
Exact mass
186.0351
XLogP
1.33
TPSA
43.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
45.37
Supplementary Information
No supplementary data available
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