Home Oxazoles 31301-45-8
31301-45-8,MFCD00052555
Catalog No.:AA003IM8

31301-45-8 | 3,5-Dimethylisoxazole-4-carbonyl chloride

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1g
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5g
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25g
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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:
AA003IM8
Chemical Name:
3,5-Dimethylisoxazole-4-carbonyl chloride
CAS Number:
31301-45-8
Molecular Formula:
C6H6ClNO2
Molecular Weight:
159.5703
MDL Number:
MFCD00052555
SMILES:
ClC(=O)c1c(C)noc1C
Properties
Properties
 
BP:
240.4°C at 760 mmHg  
Form:
Liquid  
Refractive Index:
1.4960 to 1.5000  
Stability:
Moisture Sensitive  
Storage:
Inert atmosphere;Room Temperature;  

Computed Properties
 
Complexity:
151  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
1  
XLogP3:
1.7  

Downstream Synthesis Route

[1]Tetrahedron,1972,vol.28,p.3295-3297

[2]Chemicalandpharmaceuticalbulletin,1981,vol.29,p.3548-3553

[3]JournalofOrganicChemistry,1985,vol.50,p.5660-5666

[4]Tetrahedron,2007,vol.63,p.12195-12201

[5]Patent:US2009/99199,2009,A1.Locationinpatent:Page/Pagecolumn22

[6]JournalofMedicinalChemistry,2009,vol.52,p.3047-3062

[7]Patent:WO2011/3793,2011,A1.Locationinpatent:Page/Pagecolumn89

[8]Patent:WO2013/59666,2013,A1.Locationinpatent:Paragraph00635

[9]JournalofMedicinalChemistry,2013,vol.56,p.6352-6370

[10]Patent:DE634286,1935,    Fortschr.Teerfarbenfabr.Verw.Industriezweige,vol.23,p.502

[1]JournalofHeterocyclicChemistry,1974,vol.11,p.623-626

[1]JournalofHeterocyclicChemistry,1974,vol.11,p.603-606

[1]Ajello;Migliara;Ceraulo;Petruso[JournalofHeterocyclicChemistry,1974,vol.11,#3,p.339-342]

[1]Kochetkov,N.K.etal.[JournalofgeneralchemistryoftheUSSR,1962,vol.32,p.1763-1769][ZhurnalObshcheiKhimii,1962,vol.32,p.1778-1785]

[2]CurrentPatentAssignee:UNIVERSITYOFCALIFORNIA-US6331555,2001,B1

[3]CurrentPatentAssignee:UNIVERSITYOFCALIFORNIA;YissumResearch&Development(in:HebrewUniversity);HEBREWUNIVERSITYOFJERUSALEM;PFIZERINC;MAX-PLANCK-GESELLSCHAFTZURFÖRDERUNGDERWISSENSCHAFTE.V.;BIOSIGNAL-US5990141,1999,A

Literature
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SDS
Tags:31301-45-8 Molecular Formula|31301-45-8 MDL|31301-45-8 SMILES|31301-45-8 3,5-Dimethylisoxazole-4-carbonyl chloride |Organic_Building_Blocks