Nom: sodium 5-(2-chloro-4-(trifiuoromethyl)phenoxy)-2-nitrobenzoate
SMILES:
O=C([O-])c1cc(Oc2ccc(C(F)(F)F)cc2Cl)ccc1[N+](=O)[O-].[Na+]Molecular Processing
Molecular formula
C14H6ClF3NNaO5
Molecular weight
383.64
Exact mass
382.9784
XLogP
0.43
TPSA
92.5
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
25
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
11
Covalent units
2
Fraction Csp3
0.071
Molar refractivity
73.95
Supplementary Information
Récupération des détails…
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