5-methyl-4-oxido-6-oxo-1H-pyrazin-4-ium-3-carboxylic acid
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5-methyl-4-oxido-6-oxo-1H-pyrazin-4-ium-3-carboxylic acid
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CAS No:
77168-88-8
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Formula:
C6H6N2O4
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Chemical Name:
5-methyl-4-oxido-6-oxo-1H-pyrazin-4-ium-3-carboxylic acid
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Synonyms:
4,5-dihydro-6-methyl-5-oxo-2-pyrazinecarboxylic acid 1-oxide; 4,5-Dhopzca-1; 6-methyl-1-oxido-5-oxo-4H-pyrazin-1-ium-2-carboxylic acid; Pyrazinecarboxylic acid,4,5-dihydro-6-methyl-5-oxo-,1-oxide;
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CAS No:
5-methyl-4-oxido-6-oxo-1H-pyrazin-4-ium-3-carboxylic acid Basic Attributes
170.12300
170.03275668 g/mol
DTXSID70227929
2933990090
Computed Properties
Molecular Weight:170.12
XLogP3:-1.6
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:170.03275668
Monoisotopic Mass:170.03275668
Topological Polar Surface Area:95.2
Heavy Atom Count:12
Complexity:316
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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