CCOC(=O)COC(C)C1CC1
SMILES: CCOC(=O)COC(C)C1CC1

Molecular Processing

Molecular formula
C9H16O3
Molecular weight
172.22
Exact mass
172.1099
XLogP
1.36
TPSA
35.53
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
12
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
3
Covalent units
1
Fraction Csp3
0.889
Molar refractivity
44.77

Supplementary Information

Details werden geladen…

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