(E)-4-[tert-butyl-[(4-methylphenyl)methyl]amino]-4-oxobut-2-enoic acid
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![(E)-4-[tert-butyl-[(4-methylphenyl)methyl]amino]-4-oxobut-2-enoic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/9bc51b9cdbb24bcb92a0640f87e671ad.png "(E)-4-[tert-butyl-[(4-methylphenyl)methyl]amino]-4-oxobut-2-enoic acid")
(E)-4-[tert-butyl-[(4-methylphenyl)methyl]amino]-4-oxobut-2-enoic acid
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CAS No:
313496-13-8
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Formula:
C16H21NO3
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Chemical Name:
(E)-4-[tert-butyl-[(4-methylphenyl)methyl]amino]-4-oxobut-2-enoic acid
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Synonyms:
ZINC2023896;STK025092;AKOS005379899;(2E)-4-[tert-butyl(4-methylbenzyl)amino]-4-oxobut-2-enoic acid;(E)-4-(tert-butyl(4-methylbenzyl)amino)-4-oxobut-2-enoic acid;313496-13-8
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CAS No:
(E)-4-[tert-butyl-[(4-methylphenyl)methyl]amino]-4-oxobut-2-enoic acid Basic Attributes
275.34 g/mol
275.15214353 g/mol
Computed Properties
Molecular Weight:275.34
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:5
Exact Mass:275.15214353
Monoisotopic Mass:275.15214353
Topological Polar Surface Area:57.6
Heavy Atom Count:20
Complexity:374
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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