SMILES:
C=C1CNC(=O)c2ccccc21Molecular Processing
Molecular formula
C10H9NO
Molecular weight
159.19
Exact mass
159.0684
XLogP
1.44
TPSA
29.1
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
12
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.1
Molar refractivity
47.81
Supplementary Information
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