Name: 1-(4-benzyloxyphenyl)-heptan-3-one
SMILES:
CCCCC(=O)CCc1ccc(OCc2ccccc2)cc1Molecular Processing
Molecular formula
C20H24O2
Molecular weight
296.41
Exact mass
296.1776
XLogP
4.96
TPSA
26.3
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
9
Heavy atoms
22
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.35
Molar refractivity
90.07
Supplementary Information
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