SMILES:
COc1ccccc1SMolecular Processing
Molecular formula
C7H8OS
Molecular weight
140.21
Exact mass
140.0296
XLogP
1.98
TPSA
9.23
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
9
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
40.25
Supplementary Information
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