CC(C)(C)OC(=O)C(F)=CC1C(C(=O)O)C1(C)C
SMILES: CC(C)(C)OC(=O)C(F)=CC1C(C(=O)O)C1(C)C

Molecular Processing

Molecular formula
C13H19FO4
Molecular weight
258.29
Exact mass
258.1267
XLogP
2.54
TPSA
63.6
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
18
Rings
1
Aromatic rings
0
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.692
Molar refractivity
63.43

Supplementary Information

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