이름: Isatin
SMILES:
O=C1Nc2ccccc2C1=OMolecular Processing
Molecular formula
C8H5NO2
Molecular weight
147.13
Exact mass
147.032
XLogP
0.82
TPSA
46.17
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
0
Heavy atoms
11
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0
Molar refractivity
39.4
Supplementary Information
No supplementary data available
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