Nombre: 1-isocyanato-3-phenoxybenzene
SMILES:
O=C=Nc1cccc(Oc2ccccc2)c1Molecular Processing
Molecular formula
C13H9NO2
Molecular weight
211.22
Exact mass
211.0633
XLogP
3.45
TPSA
38.66
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
16
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0
Molar refractivity
60.74
Supplementary Information
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