SMILES:
COc1nc(C)nc(Cl)c1[N+](=O)[O-]Molecular Processing
Molecular formula
C6H6ClN3O3
Molecular weight
203.59
Exact mass
203.0098
XLogP
1.36
TPSA
78.15
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
2
Heavy atoms
13
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
44.99
Supplementary Information
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