Structure Info
- Chemspace ID
- CSMB17477679496 (Enamine MADE)
- IUPAC Name
- ethyl 2,3,5,6-tetrafluoro-4-[(propylamino)methyl]benzoate
- Mol formula
- C13H15F4NO2
- Mol weight
- 293 Da
- Catalog Number(s)
- BBV-1239661576
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.34
- Heavy atoms count
- 20
- Rotatable bond count
- 7
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.46153846153846
- Polar surface area (Å)
- 38
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB17477679496
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