Structure Info
- Chemspace ID
- CSSS00000117186 (In-Stock Screening Compounds)
- CAS
- 57337-53-8, 141849-62-9
- MFCD
- MFCD04971257
- IUPAC Name
- 8-methylcubane-1-carboxylic acid
- Mol formula
- C10H10O2
- Mol weight
- 162 Da
- Catalog Number(s)
- BB4LS-EN300-6737755, BBV-38360891, BL63849, CSC000117186, EN300-6737755, FCH922639, Y3157700, Z1201623036, ZXC344113
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 0.23
- Heavy atoms count
- 12
- Rotatable bond count
- 1
- Number of rings
- 5
- Carbon bond saturation, Fsp3
- 0.9
- Polar surface area (Å)
- 37
- Hydrogen bond acceptors count
- 2
- Hydrogen bond donors count
- 1
- Zoom the structure
- CSSS00000117186
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