O=C(O)c1cnn(O)c1
名称: 1-hydroxypyrazole-4-carboxylic acid
SMILES: O=C(O)c1cnn(O)c1

Molecular Processing

Molecular formula
C4H4N2O3
Molecular weight
128.09
Exact mass
128.0222
XLogP
-0.18
TPSA
75.35
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
9
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0
Molar refractivity
26.37

Supplementary Information

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