3,3,4,4-Tetramethyl-1-oxido-diazet-1-ium
Basic information
- CAS
40543-89-3- Standard SMILES
CC1(C)N=[N+]([O-])C1(C)C- InChIKey
UDCUFMUYRZOCTR-UHFFFAOYSA-N- Molecular formula
- C6H12N2O
- Average molar mass
- 128.17 g/mol
- Monoisotopic mass
- 128.09496301
Names & identifiers
- Preferred name
- 3,3,4,4-Tetramethyl-1-oxido-diazet-1-ium
- IUPAC
- 3,3,4,4-tetramethyl-1-oxidodiazet-1-ium
Names & synonyms
NSC69161040543-89-33,3,4,4-tetramethyl-1-oxido-diazet-1-iumCHEMBL1971841DTXSID80327828NSC-691610NCI60_0329023,3,4,4-Tetramethyl-1-oxo-3,4-dihydro-1lambda~5~,2-diazete3,3,4,4-Tetramethyl-3,4-dihydro-1.lambda.~5~,2-diazet-1-ol
Database identifiers
- CAS
40543-89-3- PubChem CID
- 391930
- DTXSID
DTXSID80327828- ChEMBL
CHEMBL1971841
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 0
- Heavy atoms
- 9
- Formal charge
- 0
- Complexity
- 170
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Compound notes
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