Pyrazine, 2,5-bis(1-methylethyl)-, 1-oxide
Basic information
- CAS
65257-57-0- Standard SMILES
CC(C)c1c[n+]([O-])c(C(C)C)cn1- InChIKey
ASJHMEZPXNQLNL-UHFFFAOYSA-N- Molecular formula
- C10H16N2O
- Average molar mass
- 180.25 g/mol
- Monoisotopic mass
- 180.12626314
Names & identifiers
- Preferred name
- Pyrazine, 2,5-bis(1-methylethyl)-, 1-oxide
- IUPAC
- 1-oxido-2,5-di(propan-2-yl)pyrazin-1-ium
Names & synonyms
Pyrazine, 2,5-bis(1-methylethyl)-, 1-oxide65257-57-0DTXSID00469794RefChem:375898DTXCID904206122,5-diisopropylpyrazine 1-oxide2,5-diisopropyl-1-oxido-pyrazin-1-ium1-Oxo-2,5-di(propan-2-yl)-1lambda~5~-pyrazine
Database identifiers
- CAS
65257-57-0- PubChem CID
- 11636924
- DTXSID
DTXSID00469794
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 38.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 2
- Heavy atoms
- 13
- Formal charge
- 0
- Complexity
- 159
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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