CC(C)(C#N)c1ccc(C#N)cc1
SMILES: CC(C)(C#N)c1ccc(C#N)cc1

Molecular Processing

Molecular formula
C11H10N2
Molecular weight
170.22
Exact mass
170.0844
XLogP
2.36
TPSA
47.58
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
13
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
0.273
Molar refractivity
49.8

Supplementary Information

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