(E,4E)-3-methyl-4-[(4-nitrophenyl)methylidene]pent-2-enedioic acid
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![(E,4E)-3-methyl-4-[(4-nitrophenyl)methylidene]pent-2-enedioic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/22a9d6230e24452e8dfa3583c30d73ea.png "(E,4E)-3-methyl-4-[(4-nitrophenyl)methylidene]pent-2-enedioic acid")
(E,4E)-3-methyl-4-[(4-nitrophenyl)methylidene]pent-2-enedioic acid
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CAS No:
751469-96-2
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Formula:
C13H11NO6
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Chemical Name:
(E,4E)-3-methyl-4-[(4-nitrophenyl)methylidene]pent-2-enedioic acid
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Synonyms:
STL349529;ZINC13764721;AKOS022095729;(2E,4E)-3-methyl-4-(4-nitrobenzylidene)pent-2-enedioic acid;751469-96-2
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CAS No:
(E,4E)-3-methyl-4-[(4-nitrophenyl)methylidene]pent-2-enedioic acid Basic Attributes
277.23 g/mol
277.05863707 g/mol
Computed Properties
Molecular Weight:277.23
XLogP3:2.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:4
Exact Mass:277.05863707
Monoisotopic Mass:277.05863707
Topological Polar Surface Area:120
Heavy Atom Count:20
Complexity:466
Defined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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