SMILES:
CCOC(=O)C(C)(F)C(=O)OMolecular Processing
Molecular formula
C6H9FO4
Molecular weight
164.13
Exact mass
164.0485
XLogP
0.36
TPSA
63.6
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
11
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.667
Molar refractivity
33.78
Supplementary Information
Details werden geladen…
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