Structure Info
- Chemspace ID
- CSCS00009909961 (Synthesis)
- MFCD
- MFCD20640055
- IUPAC Name
- 7-oxocyclooct-1-ene-1-carboxylic acid
- Mol formula
- C9H12O3
- Mol weight
- 168 Da
- Catalog Number(s)
- BBV-39922539, CSC009909961, FCH1219680
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 1.45
- Heavy atoms count
- 12
- Rotatable bond count
- 1
- Number of rings
- 1
- Carbon bond saturation, Fsp3
- 0.555
- Polar surface area (Å)
- 54
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSCS00009909961
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