SMILES:
O=C(Cl)Cc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1Molecular Processing
Molecular formula
C8H5ClN2O5
Molecular weight
244.59
Exact mass
243.9887
XLogP
1.81
TPSA
103.35
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
16
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
54.31
Supplementary Information
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