SMILES:
Cc1ccccc1S(=O)(=O)OCCC1=CCCC1Molecular Processing
Molecular formula
C14H18O3S
Molecular weight
266.36
Exact mass
266.0977
XLogP
3.2
TPSA
43.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
18
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.429
Molar refractivity
70.87
Supplementary Information
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