이름: 6-chloro-2-(2,2-difluoro-ethoxy)-nicotinonitrile
SMILES:
N#Cc1ccc(Cl)nc1OCC(F)FMolecular Processing
Molecular formula
C8H5ClF2N2O
Molecular weight
218.59
Exact mass
218.0058
XLogP
2.25
TPSA
45.91
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
14
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.25
Molar refractivity
45.46
Supplementary Information
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