Structure Info
- Chemspace ID
- CSMB00013771669 (Enamine MADE)
- MFCD
- MFCD28149970
- IUPAC Name
- 1-(5-bromofuran-2-yl)but-3-yn-1-one
- Mol formula
- C8H5BrO2
- Mol weight
- 213 Da
- Catalog Number(s)
- BBV-53212625, CSC013771669
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.4
- Heavy atoms count
- 11
- Rotatable bond count
- 2
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.125
- Polar surface area (Å)
- 30
- Hydrogen bond acceptors count
- 1
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSMB00013771669
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