Name: benzo[b]thiophene-7-acetonitrile
SMILES:
N#CCc1cccc2ccsc12Molecular Processing
Molecular formula
C10H7NS
Molecular weight
173.24
Exact mass
173.0299
XLogP
2.97
TPSA
23.79
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
12
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.1
Molar refractivity
51.14
Supplementary Information
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