SMILES:
CC(C)(C)OC(=O)C1CCC(CO)S1Molecular Processing
Molecular formula
C10H18O3S
Molecular weight
218.32
Exact mass
218.0977
XLogP
1.58
TPSA
46.53
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
14
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.9
Molar refractivity
57.33
Supplementary Information
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