Name: benzo[b]thiophene-6-carbonitrile
SMILES:
N#Cc1ccc2ccsc2c1Molecular Processing
Molecular formula
C9H5NS
Molecular weight
159.21
Exact mass
159.0143
XLogP
2.77
TPSA
23.79
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
11
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
Molar refractivity
46.54
Supplementary Information
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