SMILES:
CCOC(=O)C(C)(C)Oc1cccc(CCCO)c1Molecular Processing
Molecular formula
C15H22O4
Molecular weight
266.34
Exact mass
266.1518
XLogP
2.33
TPSA
55.76
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
7
Heavy atoms
19
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.533
Molar refractivity
73.19
Supplementary Information
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