CCOC(=O)[C@@](C)(O)C(F)(F)F
名称: (R)-3,3,3-trifluoro-2-hydroxy-2-methyl-propionic acid ethyl ester
SMILES: CCOC(=O)[C@@](C)(O)C(F)(F)F

Molecular Processing

Molecular formula
C6H9F3O3
Molecular weight
186.13
Exact mass
186.0504
XLogP
0.86
TPSA
46.53
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
12
Rings
0
Aromatic rings
0
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.833
Molar refractivity
33.31

Supplementary Information

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