Structure Info
- Chemspace ID
- CSMB03598002269 (Enamine MADE)
- IUPAC Name
- 2-ethylbutyl 2,3,4,5,6-pentafluorobenzoate
- Mol formula
- C13H13F5O2
- Mol weight
- 296 Da
- Catalog Number(s)
- BBV-447623093, s_1458____25975928____11972464
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 4.82
- Heavy atoms count
- 20
- Rotatable bond count
- 6
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.461
- Polar surface area (Å)
- 26
- Hydrogen bond acceptors count
- 1
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB03598002269
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