CC(CN)(CN)COCc1ccccc1
SMILES: CC(CN)(CN)COCc1ccccc1

Molecular Processing

Molecular formula
C12H20N2O
Molecular weight
208.31
Exact mass
208.1576
XLogP
1.13
TPSA
61.27
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
6
Heavy atoms
15
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
0.5
Molar refractivity
62.31

Supplementary Information

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