2-[3-(4-Methoxyphenyl)-2-propen-1-ylidene]propanedioic acid
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![2-[3-(4-Methoxyphenyl)-2-propen-1-ylidene]propanedioic acid structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/f0937a946cbb4a8db8a6ffa766a6ab23.png "2-[3-(4-Methoxyphenyl)-2-propen-1-ylidene]propanedioic acid")
2-[3-(4-Methoxyphenyl)-2-propen-1-ylidene]propanedioic acid
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CAS No:
6342-88-7
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Formula:
C13H12O5
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Chemical Name:
2-[3-(4-Methoxyphenyl)-2-propen-1-ylidene]propanedioic acid
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Synonyms:
Propanedioic acid,2-[3-(4-methoxyphenyl)-2-propen-1-ylidene]-;Propanedioic acid,[3-(4-methoxyphenyl)-2-propenylidene]-;Malonic acid,(p-methoxycinnamal)-;2-[3-(4-Methoxyphenyl)-2-propen-1-ylidene]propanedioic acid;NSC 46659;(4-Methoxy-cinnamylidene)-malonic acid
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CAS No:
2-[3-(4-Methoxyphenyl)-2-propen-1-ylidene]propanedioic acid Basic Attributes
248.23100
248.23
46659
DTXSID90418039
Computed Properties
Molecular Weight:248.23
XLogP3:3.3
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:5
Exact Mass:248.06847348
Monoisotopic Mass:248.06847348
Topological Polar Surface Area:83.8
Heavy Atom Count:18
Complexity:346
Defined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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