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2-Hydroxy-3,3-dimethyl-1-oxo-2,3-dihydropyrazin-1-ium-4(1H)-olate

HCID 3462005
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Basic information

CAS
88571-67-9
Standard SMILES
CC1(C)C(O)[N+](=O)C=CN1[O-]
InChIKey
NWZUERGZAMDMBB-UHFFFAOYSA-N
Molecular formula
C6H10N2O3
Average molar mass
158.157 g/mol
Monoisotopic mass
158.06914218

Names & identifiers

Preferred name
2-Hydroxy-3,3-dimethyl-1-oxo-2,3-dihydropyrazin-1-ium-4(1H)-olate
IUPAC
2-Hydroxy-3,3-dimethyl-1-oxo-2,3-dihydropyrazin-1-ium-4(1H)-olate
English name
Pyrazinol, 2,3-dihydro-3,3-dimethyl-, 1,4-dioxide (9CI)
Molecular formula
C6H10N2O3
Molecular weight
158.16

Names & synonyms

3,3-DIMETHYL-2,3-DIHYDROPYRAZIN-2-OL 1,4-DIOXIDE2-Pyrazinol, 2,3-dihydro-3,3-dimethyl-, 1,4-dioxidePyrazinol, 2,3-dihydro-3,3-dimethyl-, 1,4-dioxide (9CI)

Database identifiers

CAS
88571-67-9
PubChem CID
3462005
DTXSID
DTXSID30392703
Nikkaji
J769.737F

Properties

Physicochemical properties

Melting point
162 · 162-164 °C(Solv: ethanol (64-17-5))
Boiling point
360.1 · 360.1±52.0 °C(Predicted)
Density
1.26 · 1.26±0.1 g/cm3(Predicted)
pka
9.59 · 9.59±0.40(Predicted)

Chemistry & industry

Suppliers2 total

CHEMSTEP[email protected]
Interbioscreen Ltd.[email protected]

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