1-[4-(Benzoyloxy)-2-hydroxyphenyl]-3-phenyl-1,3-propanedione
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![1-[4-(Benzoyloxy)-2-hydroxyphenyl]-3-phenyl-1,3-propanedione structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220812/bf49dfb2b4284c7489c6273557407b46.png "1-[4-(Benzoyloxy)-2-hydroxyphenyl]-3-phenyl-1,3-propanedione")
1-[4-(Benzoyloxy)-2-hydroxyphenyl]-3-phenyl-1,3-propanedione
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CAS No:
5465-06-5
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Formula:
C22H16O5
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Chemical Name:
1-[4-(Benzoyloxy)-2-hydroxyphenyl]-3-phenyl-1,3-propanedione
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Synonyms:
1-[4-(BENZOYLOXY)-2-HYDROXYPHENYL]-3-PHENYL-1,3-PROPANEDIONE;NSC26749;3-hydroxy-4-(3-oxo-3-phenylpropanoyl)phenyl benzoate;CTK5A2086;DTXSID80282600;NSC-26749;ZINC100356802;1,3-Propanedione,1-[4-(benzoyloxy)-2-hydroxyphenyl]-3-phenyl-
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CAS No:
1-[4-(Benzoyloxy)-2-hydroxyphenyl]-3-phenyl-1,3-propanedione Basic Attributes
360.365
360.10000
26749
DTXSID80282600
2916310090
1-[4-(Benzoyloxy)-2-hydroxyphenyl]-3-phenyl-1,3-propanedione Use and Manufacturing
Resorcinol can be reacted with acetic acid with the participation of zinc chloride (acetylation) to produce 2, 4-dihydroxyacetophenone, and then react with benzoyl chloride to produce 2, 4-bis(benzoyloxy)benzene Ethyl ketone, and then molecular rearrangement (benzoyl transposition) in acetone under the action of potassium hydroxide to prepare the product.
Xinmaishutong (ethyl flavonoids) intermediate.
Computed Properties
Molecular Weight:360.4
XLogP3:4.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:7
Exact Mass:360.09977361
Monoisotopic Mass:360.09977361
Topological Polar Surface Area:80.7
Heavy Atom Count:27
Complexity:531
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
1-[4-(Benzoyloxy)-2-hydroxyphenyl]-3-phenyl-1,3-propanedione
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