SMILES:
C=CC(=O)OCCCCCCOc1ccc(C(=O)O)cc1Molecular Processing
Molecular formula
C16H20O5
Molecular weight
292.33
Exact mass
292.1311
XLogP
3.05
TPSA
72.83
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
10
Heavy atoms
21
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
0.375
Molar refractivity
78.52
Supplementary Information
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