Basic information
- CAS
955-02-2- Standard SMILES
CC(C)(C)c1cc([N+]#N)cc(C(C)(C)C)c1[O-]- InChIKey
NRJGCANPWXHZFH-UHFFFAOYSA-N- Molecular formula
- C14H20N2O
- Average molar mass
- 232.32 g/mol
- Monoisotopic mass
- 232.15756327
Names & identifiers
- Preferred name
- 2,6-Ditert-butyl-4-diazoniophenolate
- IUPAC
- 2,6-ditert-butyl-4-diazoniophenolate
Names & synonyms
2,6-ditert-butyl-4-diazoniophenolate955-02-2DTXSID20344251RefChem:248598DTXCID302953262,6-Bis(1,1-dimethylethyl)-4-diazocyclohexa-2,5-dien-1-oneSCHEMBL29084828NRJGCANPWXHZFH-UHFFFAOYSA-N2,6-Di-tert-butyl-4-diazoniophenolate4-diazo-2,6-di-t-butyl-cyclohexa-2,5-dienone
Database identifiers
- CAS
955-02-2- PubChem CID
- 595368
- DTXSID
DTXSID20344251- Nikkaji
- J744.204A
Properties
Computed structural properties
- XLogP
- 6.2
- Topological polar surface area
- 51.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 291
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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