Structure Info
- Chemspace ID
- CSMB06834792861 (Enamine MADE)
- IUPAC Name
- hex-5-en-3-yl 4-bromo-2,3,5,6-tetrafluorobenzoate
- Mol formula
- C13H11BrF4O2
- Mol weight
- 355 Da
- Catalog Number(s)
- BBV-870606467, s_1458____25960210____26090656
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 5.28
- Heavy atoms count
- 20
- Rotatable bond count
- 6
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.307
- Polar surface area (Å)
- 26
- Hydrogen bond acceptors count
- 1
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB06834792861
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