Structure Info
- Chemspace ID
- CSMB06834196903 (Enamine MADE)
- IUPAC Name
- 3-(benzyloxy)propyl 4-bromo-2,3,5,6-tetrafluorobenzoate
- Mol formula
- C17H13BrF4O3
- Mol weight
- 421 Da
- Catalog Number(s)
- BBV-869990301, s_1458____25960210____14060628
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 5.05
- Heavy atoms count
- 25
- Rotatable bond count
- 8
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.235
- Polar surface area (Å)
- 36
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB06834196903
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