COC(=O)C(C)(C)C1CCC(OS(=O)(=O)c2ccc(C)cc2)CC1
SMILES: COC(=O)C(C)(C)C1CCC(OS(=O)(=O)c2ccc(C)cc2)CC1

Molecular Processing

Molecular formula
C18H26O5S
Molecular weight
354.47
Exact mass
354.1501
XLogP
3.46
TPSA
69.67
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
24
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.611
Molar refractivity
90.99

Supplementary Information

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