Structure Info
- Chemspace ID
- CSMB01392470243 (Enamine MADE)
- MFCD
- MFCD34779971
- IUPAC Name
- methyl 2-fluoro-4-(propan-2-yl)benzoate
- Mol formula
- C11H13FO2
- Mol weight
- 196 Da
- Catalog Number(s)
- BBV-184549410, CSCR01392470243, PV-002856157308, s_1458_16525364_483916, s_1458____16525364____483916
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.36
- Heavy atoms count
- 14
- Rotatable bond count
- 3
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.363
- Polar surface area (Å)
- 26
- Hydrogen bond acceptors count
- 1
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB01392470243
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