Structure Info
- Chemspace ID
- CSCS00035467139 (Synthesis)
- MFCD
- MFCD11055218
- IUPAC Name
- (4R,5S)-3-oxo-2-oxatetracyclo[7.2.1.0⁴,¹¹.0⁶,¹⁰]dodec-7-ene-5-carboxylic acid
- Mol formula
- C12H12O4
- Mol weight
- 220 Da
- Catalog Number(s)
- BBV-78304198, CSC035467139, FCH3789806
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 0.33
- Heavy atoms count
- 16
- Rotatable bond count
- 1
- Number of rings
- 4
- Carbon bond saturation, Fsp3
- 0.666
- Polar surface area (Å)
- 64
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSCS00035467139
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