SMILES:
O=C(Nc1cc(Cl)c(O)cc1[N+](=O)[O-])OCCCClMolecular Processing
Molecular formula
C10H10Cl2N2O5
Molecular weight
309.11
Exact mass
307.9967
XLogP
3.13
TPSA
101.7
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
19
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
70.08
Supplementary Information
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