الاسم: 2,2,3,3,4,4,4-heptafluoro-N-[2-(cyanomethyl)phenyl]butanamide
SMILES:
N#CCc1ccccc1NC(=O)C(F)(F)C(F)(F)C(F)(F)FMolecular Processing
Molecular formula
C12H7F7N2O
Molecular weight
328.19
Exact mass
328.0447
XLogP
3.52
TPSA
52.89
H-bond donors
1
H-bond acceptors
2
Rotatable bonds
4
Heavy atoms
22
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
60.34
Supplementary Information
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