4-oxo-4-(pyridin-2-ylamino)but-2-enoic acid
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4-oxo-4-(pyridin-2-ylamino)but-2-enoic acid
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CAS No:
42574-71-0
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Formula:
C9H8N2O3
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Chemical Name:
4-oxo-4-(pyridin-2-ylamino)but-2-enoic acid
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Synonyms:
NSC112778;42574-71-0;NCIStruc1_000006;NCIStruc2_000258;2-Butenoic acid, 4-oxo-4-(2-pyridinylamino)-, (Z)-;NCI60_000281;DS-013073;4-oxo-4-(2-pyridinylamino)-2-butenoic acid
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CAS No:
Computed Properties
Molecular Weight:192.17
XLogP3:0.4
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:192.05349212
Monoisotopic Mass:192.05349212
Topological Polar Surface Area:79.3
Heavy Atom Count:14
Complexity:250
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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