CCC(CC)COS(=O)(=O)c1ccc(C)cc1
SMILES: CCC(CC)COS(=O)(=O)c1ccc(C)cc1

Molecular Processing

Molecular formula
C13H20O3S
Molecular weight
256.37
Exact mass
256.1133
XLogP
3.14
TPSA
43.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
17
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
0.538
Molar refractivity
68.39

Supplementary Information

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