Structure Info
- Chemspace ID
- CSSS00009909902 (In-Stock Screening Compounds)
- CAS
- 26209-41-6, 79093-92-8
- MFCD
- MFCD20639987, MFCD29060140
- IUPAC Name
- 8-cyanocubane-1-carboxylic acid
- Mol formula
- C10H7NO2
- Mol weight
- 173 Da
- Catalog Number(s)
- AD256303, AZ92265, BB4LS-EN300-7459978, BBA20941, BBV-39922465, BD01183782, CSC009909902, EN300-7459978, FCH1219608, G91717, LN04701525, OR312543, SY410933, Y3206680, Z1262516040, ZXC353778
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- -0.52
- Heavy atoms count
- 13
- Rotatable bond count
- 1
- Number of rings
- 5
- Carbon bond saturation, Fsp3
- 0.8
- Polar surface area (Å)
- 61
- Hydrogen bond acceptors count
- 3
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSSS00009909902
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