Name: methyl 4-methoxy-3-(4-oxotetrahydropyran-3-yloxy)benzoate
SMILES:
COC(=O)c1ccc(OC)c(OC2COCCC2=O)c1Molecular Processing
Molecular formula
C14H16O6
Molecular weight
280.28
Exact mass
280.0947
XLogP
1.22
TPSA
71.06
H-bond donors
0
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
20
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.429
Molar refractivity
69.19
Supplementary Information
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