2-Amino-3-(3-oxo-1-propen-1-yl)-2-butenedioic acid
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2-Amino-3-(3-oxo-1-propen-1-yl)-2-butenedioic acid
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CAS No:
16597-58-3
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Formula:
C7H7NO5
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Chemical Name:
2-Amino-3-(3-oxo-1-propen-1-yl)-2-butenedioic acid
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Synonyms:
2-Butenedioic acid,2-amino-3-(3-oxo-1-propen-1-yl)-;Butenedioic acid,2-amino-3-(2-formylvinyl)-;2-Butenedioic acid,2-amino-3-(3-oxo-1-propenyl)-;2-Amino-3-(3-oxo-1-propen-1-yl)-2-butenedioic acid;2-Amino-3-carboxymuconic acid 6-semialdehyde;2-Amino-3-(3-oxoprop-1-enyl)but-2-enedioic acid
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CAS No:
Computed Properties
Molecular Weight:185.13
XLogP3:-0.5
Hydrogen Bond Donor Count:3
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:185.03242232
Monoisotopic Mass:185.03242232
Topological Polar Surface Area:118
Heavy Atom Count:13
Complexity:302
Undefined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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2-Amino-3-(3-oxo-1-propen-1-yl)-2-butenedioic acid
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