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206055-90-5,MFCD01935957
Catalog No.:AA002AF8

206055-90-5 | [3-(4-chlorophenyl)-1,2-oxazol-5-yl]methanol

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
97%
in stock  
$48.00   $34.00
- +
250mg
97%
in stock  
$102.00   $71.00
- +
1g
97%
in stock  
$213.00   $149.00
- +
5g
≥ 97% (HPLC)
in stock  
$1,023.00   $716.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA002AF8
Chemical Name:
[3-(4-chlorophenyl)-1,2-oxazol-5-yl]methanol
CAS Number:
206055-90-5
Molecular Formula:
C10H8ClNO2
Molecular Weight:
209.6290
MDL Number:
MFCD01935957
SMILES:
OCc1onc(c1)c1ccc(cc1)Cl
Properties
Computed Properties
 
Complexity:
183  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
1.8  

Downstream Synthesis Route

[1]Aicher,ThomasD.;Balkan,Bork;Bell,PhilipA.;Brand,LeonardJ.;Cheon;Deems,RhondaO.;Fell,JayB.;Fillers,WilliamS.;Fraser,JamesD.;Gao,Jiaping;Knorr,DouglasC.;Kahle,GeraldG.;Leone,ChristinaL.;Nadelson,Jeffrey;Simpson,Ronald;Smith,HowardC.[JournalofMedicinalChemistry,1998,vol.41,#23,p.4556-4566]

106-48-9    206055-90-5   
5-(4-chlorophenoxymethyl)-3-(4-chlorophenyl)isoxazole 

[1]Aicher,ThomasD.;Balkan,Bork;Bell,PhilipA.;Brand,LeonardJ.;Cheon;Deems,RhondaO.;Fell,JayB.;Fillers,WilliamS.;Fraser,JamesD.;Gao,Jiaping;Knorr,DouglasC.;Kahle,GeraldG.;Leone,ChristinaL.;Nadelson,Jeffrey;Simpson,Ronald;Smith,HowardC.[JournalofMedicinalChemistry,1998,vol.41,#23,p.4556-4566]

206055-90-5    74-88-4   
3-(4-Chloro-phenyl)-5-methoxymethyl-isoxazole 

[1]Aicher,ThomasD.;Balkan,Bork;Bell,PhilipA.;Brand,LeonardJ.;Cheon;Deems,RhondaO.;Fell,JayB.;Fillers,WilliamS.;Fraser,JamesD.;Gao,Jiaping;Knorr,DouglasC.;Kahle,GeraldG.;Leone,ChristinaL.;Nadelson,Jeffrey;Simpson,Ronald;Smith,HowardC.[JournalofMedicinalChemistry,1998,vol.41,#23,p.4556-4566]

[1]DeLuca;Giacomelli;Riu[JournalofOrganicChemistry,2001,vol.66,#20,p.6823-6825]

[1]Wang,Guijun;Wang,Dan;Bietsch,Jonathan;Chen,Anji;Sharma,Pooja[JournalofOrganicChemistry,2020,vol.85,#24,p.16136-16156]

[2]Wang,Xi-Zhao;Jia,Jiong;Zhang,Yan;Xu,Wei-Ren;Liu,Wei;Shi,Fang-Niu;Wang,Jian-Wu[JournaloftheChineseChemicalSociety,2007,vol.54,#3,p.643-652]

[3]Khalifeh,Reza;Shahriarpour,Fatemeh;Sharghi,Hashem;Aberi,Mahdi[JournaloftheIranianChemicalSociety,2018,vol.15,#4,p.813-821]

[4]Locationinpatent:experimentalpartShen,Chuansheng;Zhang,Yumin;Gan,Yuanming;Zhao,Tianqi;Gu,Qiang[LettersinOrganicChemistry,2011,vol.8,#4,p.278-281]

Literature

Title: 4-(4-Chloro-phen-yl)-5-phenyl-isoxazole.

Journal: Acta crystallographica. Section E, Structure reports online 20091001

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Tags:206055-90-5 Molecular Formula|206055-90-5 MDL|206055-90-5 SMILES|206055-90-5 [3-(4-chlorophenyl)-1,2-oxazol-5-yl]methanol |Halogenated_Heterocycles