SMILES:
CN(C)Nc1c([N+](=O)[O-])cc(C(F)(F)F)c(Cl)c1[N+](=O)[O-]Molecular Processing
Molecular formula
C9H8ClF3N4O4
Molecular weight
328.63
Exact mass
328.0186
XLogP
3.06
TPSA
101.55
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
21
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
12
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
67.07
Supplementary Information
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