SMILES:
O=C(O)c1cocn1Molecular Processing
Molecular formula
C4H3NO3
Molecular weight
113.07
Exact mass
113.0113
XLogP
0.37
TPSA
63.33
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
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
23.46
Supplementary Information
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