3-(2-Tert-butyl-3-methyl-1,3-oxazolidin-5-yl)phenol
Basic information
- CAS
105567-83-7- Standard SMILES
CN1CC(c2cccc(O)c2)OC1C(C)(C)C- InChIKey
ORIOFGXXYYXLNY-UHFFFAOYSA-N- Molecular formula
- C14H21NO2
- Average molar mass
- 235.32 g/mol
- Monoisotopic mass
- 235.15722891
Names & identifiers
- Preferred name
- 3-(2-Tert-butyl-3-methyl-1,3-oxazolidin-5-yl)phenol
- IUPAC
- 3-(2-tert-butyl-3-methyl-1,3-oxazolidin-5-yl)phenol
Names & synonyms
3-(2-tert-butyl-3-methyl-1,3-oxazolidin-5-yl)phenolBerefrine (USAN/INN)orb1698162SCHEMBL10527149AKOS022659480NS00124150D03097T30427
Database identifiers
- CAS
105567-83-7- PubChem CID
- 60017
- DTXSID
DTXSID10869448- Nikkaji
- J558.791C
Properties
Computed structural properties
- XLogP
- 3
- Topological polar surface area
- 32.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 261
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Compound notes
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