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92-45-5,MFCD00024073
Catalog No.:AA00GSYW

92-45-5 | 3-Chlorocoumarin

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100mg
98%(GC)
in stock  
$43.00   $30.00
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1g
>98.0%(GC)
in stock  
$52.00   $36.00
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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:
AA00GSYW
Chemical Name:
3-Chlorocoumarin
CAS Number:
92-45-5
Molecular Formula:
C9H5ClO2
Molecular Weight:
180.5878
MDL Number:
MFCD00024073
SMILES:
O=c1oc2ccccc2cc1Cl
NSC Number:
54855
Properties
Computed Properties
 
Complexity:
235  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
XLogP3:
2.7  

Downstream Synthesis Route

[1]Thapliyal;Singh;Khanna[SyntheticCommunications,1993,vol.23,#20,p.2821-2826]

[2]Stodulski,Maciej;Goetzinger,Alissa;Kohlhepp,StefanieV.;Gulder,Tanja[ChemicalCommunications,2014,vol.50,#26,p.3435-3438]

[3]Su,Jinling;Zhang,Yan;Chen,Mingren;Li,Weiming;Qin,Xuewei;Xie,Yanping;Qin,Lixiao;Huang,Shihua;Zhang,Min[Synlett,2019,vol.30,#5,p.630-634]

[4]Kim;Chung;Kim;Ryu[Synthesis,1993,#3,p.283-284]

[5]Yu,Dan;Ji,Ruixue;Sun,Zhihui;Li,Wenjie;Liu,Zhong-Quan[TetrahedronLetters,2021,vol.86]

[6]Perkin[JournaloftheChemicalSociety,1871,vol.24,p.43][ZeitschriftfuerChemie,1871,p.178]

[7]Perkin[JournaloftheChemicalSociety,1871,vol.24,p.43][ZeitschriftfuerChemie,1871,p.178]

[8]CurrentPatentAssignee:BASFSE-US2466657,1947,A

[9]CurrentPatentAssignee:BASFSE-US2478824,1948,A

[10]CurrentPatentAssignee:OCCIDENTALPETROLEUMCORP-US2687417,1950,A

[11]CurrentPatentAssignee:DOWINC-US2562873,1950,A

[12]Perkin[JournaloftheChemicalSociety,1871,vol.24,p.43][ZeitschriftfuerChemie,1871,p.178]

[13]Cameron,DonaldW.;Feutrill,GeoffreyI.;Thiel,JosianeM.[AustralianJournalofChemistry,1981,vol.34,#2,p.453-458]

[14]Bowden,Keith;Battah,Sinan[JournaloftheChemicalSociety.PerkinTransactions2(2001),1998,#7,p.1603-1606]

[15]CurrentPatentAssignee:GUANGXIUNIVERSITY-CN105541772,2016,ALocationinpatent:Paragraph0025;0026;0027;0028;0029;0030-0034

[16]Tripathi,KrishnaN.;Belal,Md.;Singh,RaviP.[JournalofOrganicChemistry,2020,vol.85,#2,p.1193-1201]

[1]TetrahedronLetters,2011,vol.52,p.1225-1227

[1]Locationinpatent:experimentalpartMatos,MariaJoao;Vazquez-Rodriguez,Saleta;Borges,Fernanda;Santana,Lourdes;Uriarte,Eugenio[TetrahedronLetters,2011,vol.52,#11,p.1225-1227]

19798-77-7    92-45-5   
C14H9ClN2O2 

[1]Patent:KR2018/128292,2018,A.Locationinpatent:Paragraph0114;0151-0154

Literature

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

Journal: Bioorganic & medicinal chemistry letters 20101101

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