1H-Imidazole, 1-hydroxy-2,4,5-trimethyl-, 3-oxide
Basic information
- CAS
2654-28-6- Standard SMILES
Cc1c(C)[n+]([O-])c(C)n1O- InChIKey
NEZFAHNOVRRNHD-UHFFFAOYSA-N- Molecular formula
- C6H10N2O2
- Average molar mass
- 142.16 g/mol
- Monoisotopic mass
- 142.07422757
Names & identifiers
- Preferred name
- 1H-Imidazole, 1-hydroxy-2,4,5-trimethyl-, 3-oxide
- IUPAC
- 1-hydroxy-2,4,5-trimethyl-3-oxidoimidazol-3-ium
- English name
- 1H-Imidazole, 1-hydroxy-2,4,5-trimethyl-, 3-oxide
- Molecular formula
- C6H10N2O2
- Molecular weight
- 142.1558
Names & synonyms
2654-28-61H-Imidazole, 1-hydroxy-2,4,5-trimethyl-, 3-oxideDTXSID40399324RefChem:238018DTXCID90350182AKOS0062714161-hydroxy-2,4,5-trimethylimidazole 3-oxide2,4,5-Trimethyl-3-oxo-1H-3lambda~5~-imidazol-1-ol2,4,5-TRIMETHYL-3-OXY-IMIDAZOL-1-OL
Database identifiers
- CAS
2654-28-6- PubChem CID
- 4101372
- DTXSID
DTXSID40399324- Nikkaji
- J984.685I
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 50.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 10
- Formal charge
- 0
- Complexity
- 131
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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