Basic information
- CAS
55886-33-4- Standard SMILES
CC1(C)CN(C(C)(C)C)CC(C)(C)C(O)C1=O- InChIKey
VVYXURTZLFKGCO-UHFFFAOYSA-N- Molecular formula
- C14H27NO2
- Average molar mass
- 241.37 g/mol
- Monoisotopic mass
- 241.2041791
Names & identifiers
- Preferred name
- 1-Tert-butyl-5-hydroxy-3,3,6,6-tetramethylazepan-4-one
- IUPAC
- 1-tert-butyl-5-hydroxy-3,3,6,6-tetramethylazepan-4-one
Names & synonyms
NSC15334555886-33-41-tert-butyl-5-hydroxy-3,3,6,6-tetramethylazepan-4-oneDTXSID40302757NSC-153345
Database identifiers
- CAS
55886-33-4- PubChem CID
- 290253
- DTXSID
DTXSID40302757
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 40.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 313
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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