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CAS 14002-91-6

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4,5,7-Trimethyl-2H-1-benzopyran-2-one

Description:
4,5,7-Trimethyl-2H-1-benzopyran-2-one, commonly known as a flavonoid compound, is characterized by its polycyclic structure, which includes a benzopyran moiety. This compound features three methyl groups at the 4, 5, and 7 positions, contributing to its unique chemical properties and potential biological activities. It is typically a yellow to orange crystalline solid, exhibiting solubility in organic solvents while being less soluble in water. The presence of the benzopyran structure suggests that it may exhibit antioxidant properties, which are common in flavonoids, and it may also have potential applications in pharmaceuticals and food industries due to its bioactive nature. The compound's molecular structure allows for various interactions with biological systems, making it a subject of interest in research related to health benefits and therapeutic uses. Its CAS number, 14002-91-6, is a unique identifier that facilitates the identification and study of this specific chemical substance in scientific literature and databases.
Formula:C12H12O2
InChI:InChI=1S/C12H12O2/c1-7-4-8(2)12-9(3)6-11(13)14-10(12)5-7/h4-6H,1-3H3
InChI key:InChIKey=PUBIEFXQKSKEBE-UHFFFAOYSA-N
SMILES:CC=1C=2C(=CC(C)=CC2C)OC(=O)C1
Synonyms:
  • 2H-1-Benzopyran-2-one, 4,5,7-trimethyl-
  • 4,5,7-Trimethylcoumarin
  • Coumarin, 4,5,7-trimethyl-
  • 4,5,7-Trimethyl-2H-1-benzopyran-2-one
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