Structure Info
- Chemspace ID
- CSMB03496569148 (Enamine MADE)
- CAS
- 2680773-50-4
- IUPAC Name
- 2-[3-(2,2,2-trifluoroacetyl)-2-(trifluoromethyl)-2,3-dihydro-1,3-benzoxazol-2-yl]acetic acid
- Mol formula
- C12H7F6NO4
- Mol weight
- 343 Da
- Catalog Number(s)
- EN300-28297458
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.11
- Heavy atoms count
- 23
- Rotatable bond count
- 4
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.333
- Polar surface area (Å)
- 67
- Hydrogen bond acceptors count
- 4
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSMB03496569148
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