SMILES:
CCOC(=O)C1CCOc2cc(Oc3ccc(C(=O)O)cc3)c(Cl)cc21Molecular Processing
Molecular formula
C19H17ClO6
Molecular weight
376.79
Exact mass
376.0714
XLogP
4.26
TPSA
82.06
H-bond donors
1
H-bond acceptors
5
Rotatable bonds
5
Heavy atoms
26
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.263
Molar refractivity
94.41
Supplementary Information
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