الاسم: 6-(4-benzyloxyphenyl)-2,4-hexanedione
SMILES:
CC(=O)CC(=O)CCc1ccc(OCc2ccccc2)cc1Molecular Processing
Molecular formula
C19H20O3
Molecular weight
296.37
Exact mass
296.1412
XLogP
3.75
TPSA
43.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
8
Heavy atoms
22
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
0.263
Molar refractivity
85.84
Supplementary Information
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