Structure Info
- Chemspace ID
- CSSS00021033517 (In-Stock Screening Compounds)
- CAS
- 1835653-01-4
- MFCD
- MFCD32198664
- IUPAC Name
- 4-ethyl-2,6-difluorobenzoic acid
- Mol formula
- C9H8F2O2
- Mol weight
- 186 Da
- Catalog Number(s)
- A1-21478, ArZ-UP337464, BB4LS-EN300-22838433, BBV-107534832, BE39663, CSC021033517, EN300-22838433, FCH7974369, Y3265679, Z2755951402
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.87
- Heavy atoms count
- 13
- Rotatable bond count
- 2
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.222
- Polar surface area (Å)
- 37
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSSS00021033517
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