O=C(O)c1cc([N+](=O)[O-])n[nH]1
名称: 3-nitropyrazole-5-carboxylic acid
SMILES: O=C(O)c1cc([N+](=O)[O-])n[nH]1

Molecular Processing

Molecular formula
C4H3N3O4
Molecular weight
157.09
Exact mass
157.0124
XLogP
0.02
TPSA
109.12
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
11
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0
Molar refractivity
32.2

Supplementary Information

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