Basic information
- Standard SMILES
CC(C)(C)c1cc(C(=O)N2CC(O)C2)cc(C(C)(C)C)c1O- InChIKey
UMNYUNQUMTUZKI-UHFFFAOYSA-N- Molecular formula
- C18H27NO3
- Average molar mass
- 305.4 g/mol
Names & identifiers
- Preferred name
- (3,5-Di-tert-butyl-4-hydroxy-phenyl)-(3-hydroxy-azetidin-1-yl)-methanone
- IUPAC
- (3,5-ditert-butyl-4-hydroxyphenyl)-(3-hydroxyazetidin-1-yl)methanone
Names & synonyms
SCHEMBL4598135UMNYUNQUMTUZKI-UHFFFAOYSA-N(3,5-Di-tert-butyl-4-hydroxy-phenyl)-(3-hydroxy-azetidin-1-yl)-methanone
Database identifiers
- PubChem CID
- 11645178
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 60.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 391
Related reactions
4 records
Compound notes
Loading…