CC(C)(C)C(=O)c1cc(Cl)ccc1NS(=O)(=O)C(F)(F)F
Name: N-[4-chloro-2-(2,2-dimethylpropionyl)phenyl]trifluoromethanesulfonamide
SMILES: CC(C)(C)C(=O)c1cc(Cl)ccc1NS(=O)(=O)C(F)(F)F

Molecular Processing

Molecular formula
C12H13ClF3NO3S
Molecular weight
343.75
Exact mass
343.0257
XLogP
3.83
TPSA
63.24
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
21
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
9
Covalent units
1
Fraction Csp3
0.417
Molar refractivity
73.84

Supplementary Information

Details werden geladen…

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