Name: 3-oxabicyclo[3.2.1]octan-2,4-dione
SMILES:
O=C1OC(=O)C2CCC1C2Molecular Processing
Molecular formula
C7H8O3
Molecular weight
140.14
Exact mass
140.0473
XLogP
0.49
TPSA
43.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
0
Heavy atoms
10
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.714
Molar refractivity
31.93
Supplementary Information
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