الاسم: ethyl 2-ethoxycarbonyl-4-(3-fluoro-4-methylphenyl)-2-hydroxy-4-oxobutanoate
SMILES:
CCOC(=O)C(O)(CC(=O)c1ccc(C)c(F)c1)C(=O)OCCMolecular Processing
Molecular formula
C16H19FO6
Molecular weight
326.32
Exact mass
326.1166
XLogP
1.56
TPSA
89.9
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
7
Heavy atoms
23
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.438
Molar refractivity
78.3
Supplementary Information
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