SMILES:
O=Cc1ccccc1Oc1cc(Cl)ccc1[N+](=O)[O-]Molecular Processing
Molecular formula
C13H8ClNO4
Molecular weight
277.66
Exact mass
277.0142
XLogP
3.85
TPSA
69.44
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
19
Rings
2
Aromatic rings
2
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
70.01
Supplementary Information
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