Nombre: 4-Amino-3-nitrophenylacetic acid
SMILES:
Nc1ccc(CC(=O)O)cc1[N+](=O)[O-]Molecular Processing
Molecular formula
C8H8N2O4
Molecular weight
196.16
Exact mass
196.0484
XLogP
0.8
TPSA
106.46
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
14
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
48.85
Supplementary Information
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