SMILES:
CSCCC1OCCC(C)O1Molecular Processing
Molecular formula
C8H16O2S
Molecular weight
176.28
Exact mass
176.0871
XLogP
1.89
TPSA
18.46
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
11
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
1
Molar refractivity
47.9
Supplementary Information
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