SMILES:
CCC(C(=O)O)c1ccccc1OCC(=O)OC(C)(C)CMolecular Processing
Molecular formula
C16H22O5
Molecular weight
294.35
Exact mass
294.1467
XLogP
2.99
TPSA
72.83
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
6
Heavy atoms
21
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
78.45
Supplementary Information
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