Nombre: 2-Cyclopropyl-6-[1-(ethoxy)ethenyl]-7-fluoro-5-methyl-1,3-benzoxazole-4-carbonitrile
SMILES:
C=C(OCC)c1c(C)c(C#N)c2nc(C3CC3)oc2c1FMolecular Processing
Molecular formula
C16H15FN2O2
Molecular weight
286.31
Exact mass
286.1118
XLogP
4.03
TPSA
59.05
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
21
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
76.05
Supplementary Information
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