(E,4E)-4-[(4-bromophenyl)methylidene]-3-methylpent-2-enedioic acid
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![(E,4E)-4-[(4-bromophenyl)methylidene]-3-methylpent-2-enedioic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/5da6115d6f8a4677bd2c977df43e9152.png "(E,4E)-4-[(4-bromophenyl)methylidene]-3-methylpent-2-enedioic acid")
(E,4E)-4-[(4-bromophenyl)methylidene]-3-methylpent-2-enedioic acid
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CAS No:
305865-65-0
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Formula:
C13H11BrO4
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Chemical Name:
(E,4E)-4-[(4-bromophenyl)methylidene]-3-methylpent-2-enedioic acid
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Synonyms:
(2E,4E)-4-(4-bromobenzylidene)-3-methylpent-2-enedioic acid;ZINC4770285;STK525391;AKOS005459061;NCGC00336700-01;AB00087771-01;AB00087771-03;305865-65-0
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CAS No:
(E,4E)-4-[(4-bromophenyl)methylidene]-3-methylpent-2-enedioic acid Basic Attributes
311.13 g/mol
309.98407 g/mol
Computed Properties
Molecular Weight:311.13
XLogP3:3.2
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:309.98407
Monoisotopic Mass:309.98407
Topological Polar Surface Area:74.6
Heavy Atom Count:18
Complexity:390
Defined Bond Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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