Structure Info
- Chemspace ID
- CSSS02435999027 (In-Stock Screening Compounds)
- IUPAC Name
- 3-{4-[(oxan-4-ylidene)methyl]phenyl}-3-(trifluoromethyl)-3H-diazirine
- Mol formula
- C14H13F3N2O
- Mol weight
- 282 Da
- Catalog Number(s)
- Z4223222522
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 3.81
- Heavy atoms count
- 20
- Rotatable bond count
- 3
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.428
- Polar surface area (Å)
- 34
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSSS02435999027
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