SMILES:
O=C(O)C(Cl)Cc1ccccc1[N+](=O)[O-]Molecular Processing
Molecular formula
C9H8ClNO4
Molecular weight
229.62
Exact mass
229.0142
XLogP
1.83
TPSA
80.44
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
15
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
54.08
Supplementary Information
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