Nombre: (5-(mercaptomethyl)-1,3-phenylene)dimethanol
SMILES:
OCc1cc(CO)cc(CS)c1Molecular Processing
Molecular formula
C9H12O2S
Molecular weight
184.26
Exact mass
184.0558
XLogP
1.1
TPSA
40.46
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
50.98
Supplementary Information
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