이름: 5,6-dichloro-2-(2-isopropoxyethoxy)nicotinonitrile
SMILES:
CC(C)OCCOc1nc(Cl)c(Cl)cc1C#NMolecular Processing
Molecular formula
C11H12Cl2N2O2
Molecular weight
275.13
Exact mass
274.0276
XLogP
3.06
TPSA
55.14
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
5
Heavy atoms
17
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
0.455
Molar refractivity
65.56
Supplementary Information
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