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6889-78-7,MFCD00017682
Catalog No.:AA003JGZ

6889-78-7 | 3-Hydroxy-2-(4-methoxyphenyl)-4H-chromen-4-one

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250mg
98%
in stock  
$81.00   $57.00
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1g
>98.0%(HPLC)
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$96.00   $68.00
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5g
>98.0%(HPLC)
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003JGZ
Chemical Name:
3-Hydroxy-2-(4-methoxyphenyl)-4H-chromen-4-one
CAS Number:
6889-78-7
Molecular Formula:
C16H12O4
Molecular Weight:
268.2641
MDL Number:
MFCD00017682
SMILES:
COc1ccc(cc1)c1oc2ccccc2c(=O)c1O
NSC Number:
102030
Properties
Properties
 
Form:
Solid  
MP:
233-234°C  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
407  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
3.4  

Downstream Synthesis Route
2-(4-methoxyphenyl)-2,3-dihydro-4H-chromen-4-one 
  6889-78-7 

[1]Oyamada[BulletinoftheChemicalSocietyofJapan,1935,vol.10,p.182,185]

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[1]Dhoubhadel,S.P.;Tuladhar,SudersanM.;Tuladhar,SarbajnaM.;Wagley,PradyumnaP.[IndianJournalofChemistry-SectionBOrganicandMedicinalChemistry,1981,vol.20,#6,p.511-512]

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[5]Locationinpatent:schemeortableLiu,Xin-Hua;Liu,Hui-Feng;Shen,Xu;Song,Bao-An;Bhadury,PinakiS.;Zhu,Hai-Liang;Liu,Jin-Xing;Qi,Xing-Bao[BioorganicandMedicinalChemistryLetters,2010,vol.20,#14,p.4163-4167]

[6]Locationinpatent:experimentalpartBritton,RobertG.;Horner-Glister,Emma;Pomenya,OdetteA.;Smith,EwanE.;Denton,Roanne;Jenkins,PaulR.;Steward,WilliamP.;Brown,Karen;Gescher,Andreas;Sale,Stewart[EuropeanJournalofMedicinalChemistry,2012,vol.54,p.952-958]

[7]D'Aleo,Anthony;Fages,Frederic[PhotochemicalandPhotobiologicalSciences,2013,vol.12,#3,p.500-510]

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[9]Burmistrova,Olga;Marrero,MaríaTeresa;Estévez,Sara;Welsch,Isabel;Brouard,Ignacio;Quintana,José;Estévez,Francisco[EuropeanJournalofMedicinalChemistry,2014,vol.84,p.30-41]

[10]Khanna,Radhika;Kumar,Ramesh;Dalal,Aarti;Kamboj,RameshC.[JournalofFluorescence,2015,vol.25,#5,p.1159-1163]

[11]Thakor,Vanrajsinh;Poddar,Mayur;Dey,Sumit;Manjula;Madhunapantula,SubbaraoV.;Pawara,Rahul;Patel,HarunM.;Noolvi,MalleshappaN.[RSCAdvances,2016,vol.6,#82,p.79166-79179]

[12]Singh,AshokKumar;Saxena,Gunjan;Sahabjada;Arshad[SpectrochimicaActaPartA:MolecularandBiomolecularSpectroscopy,2017,vol.180,p.97-104]

[13]Das,Sreeparna;Batuta,Shaikh;Alam,Md.Niharul;Fouzder,Chandrani;Kundu,Rakesh;Mandal,Debabrata;Begum,NazninAra[ColloidsandSurfacesB:Biointerfaces,2017,vol.157,p.286-296]

[14]Mughal,EhsanUllah;Javid,Asif;Sadiq,Amina;Murtaza,Shahzad;Zafar,MuhammadNaveed;Khan,BilalAhmad;Sumra,SajjadHussain;Tahir,MuhammadNawaz;Kanwal;Khan,KhalidMohammed[BioorganicandMedicinalChemistry,2018,vol.26,#12,p.3696-3706]

[15]Singh,AshokK.;Patel,SureshK.;Jafri,Asif[AsianJournalofChemistry,2019,vol.31,#9,p.2015-2021]

[16]Bojarski,Piotr;Kozakiewicz,Karol;Liberek,Beata;Myszka,Henryk;Nowacki,Andrzej;Reszka,Milena;Serdiuk,IlliaE.[OrganicandBiomolecularChemistry,2020,vol.18,#38,p.7635-7648]

[17]Ashraf,Jamshaid;Mughal,EhsanUllah;Sadiq,Amina;Bibi,Maryam;Naeem,Nafeesa;Ali,Anser;Massadaq,Anam;Fatima,Nighat;Javid,Asif;Zafar,MuhammadNaveed;Khan,BilalAhmad;Nazar,MuhammadFaizan;Mumtaz,Amara;Tahir,MuhammadNawaz;Mirzaei,Masoud[JournalofBiomolecularStructureandDynamics,2021,vol.39,#18,p.7107-7122]

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[1]Kumar;Singh[SyntheticCommunications,1992,vol.22,#9,p.1333-1337]

[2]Moriarty,RobertM.;Prakash,Om;Musallam,HikmatA.;Mahesh,VijendraK.[Heterocycles,1986,vol.24,#6,p.1641-1645]

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Literature

Title: Design, synthesis and exploring the quantitative structure-activity relationship of some antioxidant flavonoid analogues.

Journal: Bioorganic & medicinal chemistry letters 20141101

Title: Synthesis and biological evaluation of novel flavonols as potential anti-prostate cancer agents.

Journal: European journal of medicinal chemistry 20120801

Title: Improved hydration-sensitive dual-fluorescence labels for monitoring peptide-nucleic acid interactions.

Journal: Bioconjugate chemistry 20110119

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

Title: Variation in chemotactic preferences of Aphanomyces cochlioides zoospores to flavonoids.

Journal: Zeitschrift fur Naturforschung. C, Journal of biosciences 20090101

Title: Understanding the cardioprotective effects of flavonols: discovery of relaxant flavonols without antioxidant activity.

Journal: Journal of medicinal chemistry 20080327

Title: Chalcones and flavonoids as anti-tuberculosis agents.

Journal: Bioorganic & medicinal chemistry 20020801

Title: Islam MT. Variation in chemotactic preferences of Aphanomyces cochlioides zoospores to flavonoids. Z Naturforsch C. 2009 Nov-Dec;64(11-12):847-52.

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