SMILES:
O=Cc1cc(O)c(O)c([N+](=O)[O-])c1Molecular Processing
Molecular formula
C7H5NO5
Molecular weight
183.12
Exact mass
183.0168
XLogP
0.82
TPSA
100.67
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
13
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
Molar refractivity
41.81
Supplementary Information
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