SMILES:
O=C(O)c1ccc(O)cc1OMolecular Processing
Molecular formula
C7H6O4
Molecular weight
154.12
Exact mass
154.0266
XLogP
0.8
TPSA
77.76
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
1
Heavy atoms
11
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
Molar refractivity
36.73
Supplementary Information
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