Nc1cc(C(F)(F)F)c(F)cc1[N+](=O)[O-]
Name: 3-amino-6-fluoro-4-nitrobenzotrifluoride
SMILES: Nc1cc(C(F)(F)F)c(F)cc1[N+](=O)[O-]

Molecular Processing

Molecular formula
C7H4F4N2O2
Molecular weight
224.11
Exact mass
224.0209
XLogP
2.33
TPSA
69.16
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
15
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
0.143
Molar refractivity
42.47

Supplementary Information

Details werden geladen…

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