C1=C(NN=C1)[N+](=O)[O-]
CAS: 26621-44-3
Nombre: 5-nitro-1H-pyrazole
SMILES: C1=C(NN=C1)[N+](=O)[O-]

Molecular Processing

Molecular formula
C3H3N3O2
Molecular weight
113.08
Exact mass
113.0225
XLogP
0.32
TPSA
71.82
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
5
Covalent units
1
Fraction Csp3
0
Molar refractivity
25.24

Supplementary Information

InChIKey: MZRUFMBFIKGOAL-UHFFFAOYSA-N
Sinónimos
26621-44-33-NitropyrazoleDjw-94DTXSID20181168RefChem:504509DTXCID301036593-Nitro-1H-pyrazole5-nitro-1H-pyrazole1H-Pyrazole, 3-nitro-nitropyrazoleDjw 94MFCD00159621Pyrazole, 3-nitro-MFCD002387873-nitro-2H-pyrazole5-NITRO-1H-PYRAZOL5-nitropyrazoleaci-nitropyrazole3-Nitro-pyrazole3-nitro-(1H)pyrazoleSCHEMBL938SCHEMBL116884SCHEMBL353538SCHEMBL751855orb2940440SCHEMBL1025867SCHEMBL1689690SCHEMBL2037848SCHEMBL2041806SCHEMBL13011421
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