Nc1ccc(Br)cc1C(F)(F)F
SMILES: Nc1ccc(Br)cc1C(F)(F)F

Molecular Processing

Molecular formula
C7H5BrF3N
Molecular weight
240.02
Exact mass
238.9557
XLogP
3.05
TPSA
26.02
H-bond donors
1
H-bond acceptors
1
Rotatable bonds
0
Heavy atoms
12
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.143
Molar refractivity
43.56

Supplementary Information

Details werden geladen…

An 57 Reaktionen beteiligt