573-54-6 Purity
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Specification
The molecular formula of isoflavone is C15H10O2.
The molecular weight of isoflavone is 222.24 g/mol.
Isoflavone is described as the simplest member of the class of isoflavones that is 4H-chromen-4-one in which the hydrogen at position 3 is replaced by a phenyl group.
Some synonyms of isoflavone include 3-phenyl-4H-chromen-4-one, 3-phenylchromen-4-one, and 4H-1-Benzopyran-4-one, 3-phenyl-.
Isoflavone is naturally found in Astragalus mongholicus, Medicago sativa, and other organisms with available data.
The IUPAC name of isoflavone is 3-phenylchromen-4-one.
The InChI code of isoflavone is InChI=1S/C15H10O2/c16-15-12-8-4-5-9-14(12)17-10-13(15)11-6-2-1-3-7-11/h1-10H.
The InChIKey of isoflavone is GOMNOOKGLZYEJT-UHFFFAOYSA-N.
The canonical SMILES representation of isoflavone is C1=CC=C(C=C1)C2=COC3=CC=CC=C3C2=O.
The CAS number of isoflavone is 574-12-9.
Reference: [1]Proceedings of the Royal Irish Academy. Section B: Biological, geological, and chemical science,1943,vol. 49 B,p. 225,229, 246
Reference: [1]Journal of Chemical Research,2008,p. 683 - 685
[2]Journal of the Chemical Society,1958,p. 2495,2499
[3]Chemistry and industry,1954,p. 1201
Reference: [1]Journal of Chemical Research,2008,p. 683 - 685
[2]Zhurnal Obshchei Khimii,1959,vol. 29,p. 2868,2873; engl. Ausg. S. 2828, 2832