SMILES:
O=C1Cc2ccc(C(=O)O)cc2N1Molecular Processing
Molecular formula
C9H7NO3
Molecular weight
177.16
Exact mass
177.0426
XLogP
0.88
TPSA
66.4
H-bond donors
2
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
13
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.111
Molar refractivity
45.74
Supplementary Information
No supplementary data available
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