SMILES:
SCCCOc1ccccc1Molecular Processing
Molecular formula
C9H12OS
Molecular weight
168.26
Exact mass
168.0609
XLogP
2.39
TPSA
9.23
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
11
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
0.333
Molar refractivity
50.41
Supplementary Information
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