Cas no 4222-02-0 (2H-1-Benzopyran-2-one,4,5,7-trihydroxy-3-phenyl-)

2H-1-Benzopyran-2-one,4,5,7-trihydroxy-3-phenyl- structure
4222-02-0 structure
Product Name:2H-1-Benzopyran-2-one,4,5,7-trihydroxy-3-phenyl-
CAS No:4222-02-0
MF:C15H10O5
MW:270.236904621124
CID:325079
PubChem ID:24880859
Update Time:2025-11-01

2H-1-Benzopyran-2-one,4,5,7-trihydroxy-3-phenyl- Chemical and Physical Properties

Names and Identifiers

    • 2H-1-Benzopyran-2-one,4,5,7-trihydroxy-3-phenyl-
    • 4,5,7-TRIHYDROXY-3-PHENYL COUMARIN
    • 4,5,7-trihydroxy-3-phenylchromen-2-one
    • 2,5,7-trihydroxy-3-phenylchromen-4-one
    • 4,5,7-trihydroxy-3-phenyl-chromen-2-one
    • 4,5,7-Trihydroxy-3-phenyl-coumarin
    • 4,5,7-Trihydroxy-3-phenyl-cumarin
    • Coumarin,4,5,7-trihydroxy-3-phenyl
    • 4,5,7-Trihydroxy-3-phenyl-2H-chromen-2-one
    • AKOS005258726
    • 4,5,7-Trihydroxy-3-phenylcoumarin
    • RUSXZMPXIYUKLA-UHFFFAOYSA-N
    • AR-683/43306486
    • FT-0769397
    • 4222-02-0
    • 2H-1-Benzopyran-2-one, 4,5,7-trihydroxy-3-phenyl-
    • DTXSID20715664
    • Coumarin, 4,5,7-trihydroxy-3-phenyl-
    • 3-Phenyl-4,5,7-trihydroxycoumarin
    • 4,5,7-Trihydroxy-3-phenyl-2H-1-benzopyran-2-one
    • 4,5,7-Trihydroxy-3-phenyl-2H-chromen-2-one #
    • DB-081509
    • Inchi: 1S/C15H10O5/c16-9-6-10(17)13-11(7-9)20-15(19)12(14(13)18)8-4-2-1-3-5-8/h1-7,16-18H
    • InChI Key: RUSXZMPXIYUKLA-UHFFFAOYSA-N
    • SMILES: O1C(C(C2C=CC=CC=2)=C(C2C(=CC(=CC1=2)O)O)O)=O

Computed Properties

  • Exact Mass: 270.05300
  • Monoisotopic Mass: 270.053
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 1
  • Complexity: 424
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 87A^2
  • XLogP3: 2.7

Experimental Properties

  • Density: 1.579
  • Melting Point: 268-272?°C
  • Boiling Point: 591°Cat760mmHg
  • Flash Point: 231.2°C
  • Refractive Index: 1.748
  • PSA: 90.90000
  • LogP: 2.57680

2H-1-Benzopyran-2-one,4,5,7-trihydroxy-3-phenyl- Security Information

  • Symbol: GHS07
  • Signal Word:Warning
  • Hazard Statement: H315-H319-H335
  • Warning Statement: P261-P305+P351+P338
  • Hazardous Material transportation number:NONH for all modes of transport
  • WGK Germany:3
  • Hazard Category Code: 36/37/38
  • Safety Instruction: S26
  • Hazardous Material Identification: Xi
  • Risk Phrases:R36/37/38

2H-1-Benzopyran-2-one,4,5,7-trihydroxy-3-phenyl- Customs Data

  • HS CODE:2932209090
  • Customs Data:

    China Customs Code:

    2932209090

    Overview:

    2932209090. Other lactones. VAT:17.0%. Tax refund rate:13.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:20.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2932209090. other lactones. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

2H-1-Benzopyran-2-one,4,5,7-trihydroxy-3-phenyl- Pricemore >>

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Additional information on 2H-1-Benzopyran-2-one,4,5,7-trihydroxy-3-phenyl-

Recent Advances in the Study of 2H-1-Benzopyran-2-one,4,5,7-trihydroxy-3-phenyl- (CAS: 4222-02-0): A Comprehensive Research Brief

The compound 2H-1-Benzopyran-2-one,4,5,7-trihydroxy-3-phenyl-, commonly referred to by its CAS number 4222-02-0, has garnered significant attention in the field of chemical biology and pharmaceutical research due to its unique structural properties and potential therapeutic applications. Recent studies have explored its pharmacological activities, synthetic pathways, and mechanisms of action, providing valuable insights for drug development and biomedical applications.

One of the most notable findings in recent research is the compound's potent antioxidant and anti-inflammatory properties. A 2023 study published in the *Journal of Medicinal Chemistry* demonstrated that 4222-02-0 exhibits strong free radical scavenging activity, which could be leveraged in the treatment of oxidative stress-related diseases such as neurodegenerative disorders and cardiovascular diseases. The study utilized in vitro assays and molecular docking simulations to elucidate the compound's interaction with key enzymes involved in oxidative pathways.

In addition to its antioxidant effects, 4222-02-0 has shown promising anticancer activity. Research conducted by a team at the National Cancer Institute revealed that the compound induces apoptosis in several cancer cell lines, including breast and lung cancer, through the modulation of the PI3K/AKT signaling pathway. These findings were further supported by in vivo studies using murine models, where the compound demonstrated significant tumor growth inhibition with minimal toxicity to normal cells.

The synthetic chemistry community has also made strides in optimizing the production of 4222-02-0. A recent publication in *Organic Letters* detailed a novel, high-yield synthesis route that employs green chemistry principles, reducing the reliance on hazardous reagents and improving the overall sustainability of the process. This advancement is particularly relevant for scaling up production for preclinical and clinical studies.

Despite these promising developments, challenges remain in the clinical translation of 4222-02-0. Pharmacokinetic studies indicate that the compound has low bioavailability, prompting researchers to explore formulation strategies such as nanoparticle encapsulation and prodrug derivatization. Ongoing research aims to address these limitations while further elucidating the compound's mechanism of action and potential off-target effects.

In conclusion, the latest research on 2H-1-Benzopyran-2-one,4,5,7-trihydroxy-3-phenyl- (CAS: 4222-02-0) highlights its multifaceted therapeutic potential and underscores the need for continued investigation. Future studies should focus on optimizing its pharmacological profile and advancing it through the drug development pipeline to harness its full clinical potential.

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