methyl (Z)-4-(butylamino)-4-oxobut-2-enoate
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methyl (Z)-4-(butylamino)-4-oxobut-2-enoate
structure -
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CAS No:
92989-16-7
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Formula:
C9H15NO3
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Chemical Name:
methyl (Z)-4-(butylamino)-4-oxobut-2-enoate
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Synonyms:
Methyl N-butylmaleamate;N-butyl methyl maleamate;methyl (Z)-4-(butylamino)-4-oxobut-2-enoate;SCHEMBL1831126;N-Butylmaleamidic acid methyl ester;2-Butenoic acid, 4-(butylamino)-4-oxo-, methyl ester, (Z)-;ZINC103641753;Maleamic acid, N-butyl-, methyl ester;92989-16-7
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CAS No:
Computed Properties
Molecular Weight:185.22
XLogP3:0.9
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:6
Exact Mass:185.10519334
Monoisotopic Mass:185.10519334
Topological Polar Surface Area:55.4
Heavy Atom Count:13
Complexity:199
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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