Structure Info
- Chemspace ID
- CSCS00103327625 (Synthesis)
- CAS
- 474925-35-4
- MFCD
- MFCD32736874
- IUPAC Name
- tert-butyl (3aR,7aS)-octahydro-1H-isoindole-2-carboxylate
- Mol formula
- C13H23NO2
- Mol weight
- 225 Da
- Catalog Number(s)
- BBV-72590405, CSC004653607, CSC103327625, CSCR00004653607, EN300-7132646, Z2278981166, m_282070_22225552_26287130, m_282070____22225552____26287130
- Copy structure to query editor
- SMILES
- INCHI
- INCHI key
- MOL
Properties
- LogP
- 2.65
- Heavy atoms count
- 16
- Rotatable bond count
- 2
- Number of rings
- 2
- Carbon bond saturation, Fsp3
- 0.923
- Polar surface area (Å)
- 30
- Hydrogen bond acceptors count
- 1
- Hydrogen bond donors count
- 0
- Zoom the structure
- CSCS00103327625
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