Structure Info
- Chemspace ID
- CSSB14888538643 (In-Stock Building Blocks)
- CAS
- 3028156-50-2
- MFCD
- MFCD35253243
- IUPAC Name
- 1-(4-bromophenyl)-2-oxabicyclo[2.1.1]hexane-4-carboxylic acid
- Mol formula
- C12H11BrO3
- Mol weight
- 283 Da
- Catalog Number(s)
- BBV-1057486825, EN300-46673903, ZX-NM307093
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.47
- Heavy atoms count
- 16
- Rotatable bond count
- 2
- Number of rings
- 3
- Carbon bond saturation, Fsp3
- 0.416
- Polar surface area (Å)
- 47
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSSB14888538643
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