SMILES:
COC(=O)C[C@@H]1COc2cc(O)ccc21Molecular Processing
Molecular formula
C11H12O4
Molecular weight
208.21
Exact mass
208.0736
XLogP
1.43
TPSA
55.76
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
15
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.364
Molar refractivity
52.98
Supplementary Information
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