Tris[5-tert-butyl-2-(4,4-dimethyl-4,5-dihydro-1,3-oxazol-2-yl)phenyl]methanol
Basic information
- CAS
5215-34-9- Standard SMILES
CC1(C)COC(c2ccc(C(C)(C)C)cc2C(O)(c2cc(C(C)(C)C)ccc2C2=NC(C)(C)CO2)c2cc(C(C)(C)C)ccc2C2=NC(C)(C)CO2)=N1- InChIKey
XTBZWYQGJFWGHF-UHFFFAOYSA-N- Molecular formula
- C46H61N3O4
- Average molar mass
- 720 g/mol
- Monoisotopic mass
- 719.46620744
Names & identifiers
- Preferred name
- Tris[5-tert-butyl-2-(4,4-dimethyl-4,5-dihydro-1,3-oxazol-2-yl)phenyl]methanol
- IUPAC
- tris[5-tert-butyl-2-(4,4-dimethyl-5H-1,3-oxazol-2-yl)phenyl]methanol
Names & synonyms
5215-34-9NSC266246DTXSID00313102NSC-266246Tris[5-tert-butyl-2-(4,4-dimethyl-4,5-dihydro-1,3-oxazol-2-yl)phenyl]methanol
Database identifiers
- CAS
5215-34-9- PubChem CID
- 320073
- DTXSID
DTXSID00313102
Properties
Computed structural properties
- XLogP
- 9.6
- Topological polar surface area
- 85 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 9
- Heavy atoms
- 53
- Formal charge
- 0
- Complexity
- 1,270
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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