Structure Info
- Chemspace ID
- CSMB00010189773 (Enamine MADE)
- MFCD
- MFCD14698346
- IUPAC Name
- ethyl 4-bromo-2,3,5,6-tetrafluorobenzoate
- Mol formula
- C9H5BrF4O2
- Mol weight
- 301 Da
- Catalog Number(s)
- A010048909, AA01KC46, BBV-78406039, CSC010189773, FCH2817584, s_1458_25960210_483918, s_1458____25960210____483918
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.67
- Heavy atoms count
- 16
- Rotatable bond count
- 3
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.222
- Polar surface area (Å)
- 26
- Hydrogen bond acceptors count
- 1
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB00010189773
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