O=C(O)c1ccc(O)c(CO)c1
SMILES: O=C(O)c1ccc(O)c(CO)c1

Molecular Processing

Molecular formula
C8H8O4
Molecular weight
168.15
Exact mass
168.0423
XLogP
0.58
TPSA
77.76
H-bond donors
3
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
12
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
0.125
Molar refractivity
40.99

Supplementary Information

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