SMILES:
CCOc1c(Cl)cc2c([nH]c3cnccc32)c1[N+](=O)[O-]Molecular Processing
Molecular formula
C13H10ClN3O3
Molecular weight
291.69
Exact mass
291.0411
XLogP
3.68
TPSA
81.05
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
20
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.154
Molar refractivity
76.43
Supplementary Information
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