SMILES:
OCCOC1(c2ccc(O)cc2)OCCO1Molecular Processing
Molecular formula
C11H14O5
Molecular weight
226.23
Exact mass
226.0841
XLogP
0.56
TPSA
68.15
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
16
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.455
Molar refractivity
54.73
Supplementary Information
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