O=[N+]([O-])c1ccc(C(F)(F)F)c(Br)c1
Nombre: 2-bromo-4-nitro-1-(trifluoromethyl)benzene
SMILES: O=[N+]([O-])c1ccc(C(F)(F)F)c(Br)c1

Molecular Processing

Molecular formula
C7H3BrF3NO2
Molecular weight
270
Exact mass
268.9299
XLogP
3.38
TPSA
43.14
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
14
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
0.143
Molar refractivity
45.8

Supplementary Information

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