SMILES:
CCOC(=O)c1ccc(OCCOCCO)cc1Molecular Processing
Molecular formula
C13H18O5
Molecular weight
254.28
Exact mass
254.1154
XLogP
1.25
TPSA
64.99
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
8
Heavy atoms
18
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.462
Molar refractivity
65.8
Supplementary Information
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