SMILES:
COc1cccc(Oc2cc(Cl)c(Cl)cc2[N+](=O)[O-])c1OCMolecular Processing
Molecular formula
C14H11Cl2NO5
Molecular weight
344.15
Exact mass
343.0014
XLogP
4.71
TPSA
70.83
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
22
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
82.74
Supplementary Information
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