SMILES:
COc1cc(C(=O)O)cc(O)c1OCMolecular Processing
Molecular formula
C9H10O5
Molecular weight
198.17
Exact mass
198.0528
XLogP
1.11
TPSA
75.99
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
14
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
0.222
Molar refractivity
48.17
Supplementary Information
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