SMILES:
COC(=O)c1ccc2oc(=O)[nH]c2c1Molecular Processing
Molecular formula
C9H7NO4
Molecular weight
193.16
Exact mass
193.0375
XLogP
0.91
TPSA
72.3
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
14
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.111
Molar refractivity
48.17
Supplementary Information
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