Name: 2,4-difluorophenyl acetonitrile
SMILES:
N#CCc1ccc(F)cc1FMolecular Processing
Molecular formula
C8H5F2N
Molecular weight
153.13
Exact mass
153.039
XLogP
2.03
TPSA
23.79
H-bond donors
0
H-bond acceptors
1
Rotatable bonds
1
Heavy atoms
11
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
35.68
Supplementary Information
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