Basic information
- CAS
24374-38-7- Standard SMILES
Cc1cn(O)c[n+]1[O-]- InChIKey
VYNJQZZELSAPLR-UHFFFAOYSA-N- Molecular formula
- C4H6N2O2
- Average molar mass
- 114.1 g/mol
- Monoisotopic mass
- 114.04292744
Names & identifiers
- Preferred name
- 4-Methyl-1h-imidazol-1-ol 3-oxide
- IUPAC
- 1-hydroxy-4-methyl-3-oxidoimidazol-3-ium
- English name
- 1-hydroxy-4-methylimidazole 3-oxide
- Molecular formula
- C4H6N2O2
- Molecular weight
- 114.1
Names & synonyms
4-methyl-1h-imidazol-1-ol 3-oxide1-Hydroxy-4-methyl-1H-imidazole 3-oxide4-methylimidazole-1,3-diolSTK556134AKOS005482321NS00052002ST50998947Einecs 246-210-81-hydroxy-4-methylimidazole 3-oxide1H-Imidazole, 1-hydroxy-4-methyl-, 3-oxide
Database identifiers
- CAS
24374-38-7- PubChem CID
- 90482
- DTXSID
DTXSID901266668- Nikkaji
- J287.232C
Properties
Computed structural properties
- XLogP
- 0.2
- Topological polar surface area
- 50.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 8
- Formal charge
- 0
- Complexity
- 88.1
Chemistry & industry
Suppliers4 total
PHARMEKS Ltd.[email protected]
Interbioscreen Ltd.[email protected]
VITAS-BB—
CHEMICAL LAND21[email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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