Name: 2-methyl-4-thiocyanato-phenol
SMILES:
Cc1cc(SC#N)ccc1OMolecular Processing
Molecular formula
C8H7NOS
Molecular weight
165.22
Exact mass
165.0248
XLogP
2.27
TPSA
44.02
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
11
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
0.125
Molar refractivity
44.31
Supplementary Information
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