SMILES:
Oc1ccc(O)nn1Molecular Processing
Molecular formula
C4H4N2O2
Molecular weight
112.09
Exact mass
112.0273
XLogP
-0.11
TPSA
66.24
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
0
Heavy atoms
8
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0
Molar refractivity
25.36
Supplementary Information
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