CC1(C)OC(=O)C2(CC2)C(=O)O1
Name: 6,6-dimethyl-5,7-dioxaspiro[2.5]octane-4,8-dione
SMILES: CC1(C)OC(=O)C2(CC2)C(=O)O1

Molecular Processing

Molecular formula
C8H10O4
Molecular weight
170.16
Exact mass
170.0579
XLogP
0.6
TPSA
52.6
H-bond donors
0
H-bond acceptors
4
Rotatable bonds
0
Heavy atoms
12
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.75
Molar refractivity
37.93

Supplementary Information

Details werden geladen…

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