Name: 6-hydroxy-1,4-benzodioxin-2-carboxylic acid
SMILES:
O=C(O)C1=COc2cc(O)ccc2O1Molecular Processing
Molecular formula
C9H6O5
Molecular weight
194.14
Exact mass
194.0215
XLogP
1.09
TPSA
75.99
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
1
Heavy atoms
14
Rings
2
Aromatic rings
1
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0
Molar refractivity
45.08
Supplementary Information
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