Structure Info
- Chemspace ID
- CSMB06339674208 (Enamine MADE)
- IUPAC Name
- 2-ethyl-2-methylpent-4-en-1-yl 2,3,6-trifluorobenzoate
- Mol formula
- C15H17F3O2
- Mol weight
- 286 Da
- Catalog Number(s)
- BBV-531130632, s_1458____8989680____26094842
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 5.06
- Heavy atoms count
- 20
- Rotatable bond count
- 7
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.4
- Polar surface area (Å)
- 26
- Hydrogen bond acceptors count
- 1
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB06339674208
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