CCOC(=O)C1(C2C1C(=O)CC2)F
CAS: 260353-76-2
Название: ethyl (1R,5R,6R)-6-fluoro-2-oxobicyclo[3.1.0]hexane-6-carboxylate
SMILES: CCOC(=O)C1(C2C1C(=O)CC2)F

Molecular Processing

Molecular formula
C9H11FO3
Molecular weight
186.18
Exact mass
186.0692
XLogP
0.87
TPSA
43.37
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
13
Rings
2
Aromatic rings
0
Saturated rings
2
Aliphatic rings
2
Stereo centers
3
Undefined stereo
3
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.778
Molar refractivity
41.69

Supplementary Information

InChIKey: KTHVHYFSCLTFTI-SLBFFKMLSA-N
Синонимы
ETHYL (1R,5R,6R)-6-FLUORO-2-OXOBICYCLO[3.1.0]HEXANE-6-CARBOXYLATESCHEMBL515296KTHVHYFSCLTFTI-SLBFFKMLSA-N260353-76-2AKOS015899408(1R,5R,6R)-6-fluoro-2-oxobicyclo[3.1.0]hexane-6-carboxylic acid ethyl ester(1r,5r,6r)-6-fluoro-2-oxo-bicyclo[3.1.0]hexane-6-carboxylate ethyl esterethyl (1r,5r,6r)-6-fluoro-2-oxo-bicyclo[3.1.0]hexane-6-carboxylate(1r, 5r, 6r)-6-fluoro-2-oxo-bicyclo[3.1.0]hexane-6-carboxylate ethyl ester
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