Name: 5-fluoro-2-(methyloxy)-4-oxiran-2-ylbenzonitrile
SMILES:
COc1cc(C2CO2)c(F)cc1C#NMolecular Processing
Molecular formula
C10H8FNO2
Molecular weight
193.18
Exact mass
193.0539
XLogP
1.78
TPSA
45.55
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
14
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.3
Molar refractivity
46.36
Supplementary Information
Details werden geladen…
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