Home Oxazoles 7064-35-9
7064-35-9,MFCD00030520
Catalog No.:AA005H4B

7064-35-9 | 5-(4-Methylphenyl)isoxazole

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  • Technical Information
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  • Downstream Synthesis Route
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA005H4B
Chemical Name:
5-(4-Methylphenyl)isoxazole
CAS Number:
7064-35-9
Molecular Formula:
C10H9NO
Molecular Weight:
159.1846
MDL Number:
MFCD00030520
SMILES:
Cc1ccc(cc1)c1ccno1
NSC Number:
111918
Properties
Properties
 
BP:
290°C at 760 mmHg  
Form:
Solid  
MP:
60°C  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
141  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
1  
XLogP3:
2.4  

Downstream Synthesis Route

[1]Wilson,B.D.;Burness,D.M.[JournalofOrganicChemistry,1966,vol.31,p.1565-1569]

[2]Woodward,R.B.etal.[Tetrahedron,Supplement,1966,vol.8,p.321-340]

[1]Lin,Yang-i;Lang,Stanley,A.[JournalofOrganicChemistry,1980,vol.45,#24,p.4857-4860]

[2]Wilson,B.D.;Burness,D.M.[JournalofOrganicChemistry,1966,vol.31,p.1565-1569]

[1]Sakaki,Junichi;Murata,Toshiki;Yuumoto,Yoko;Nakamura,Ikushi;Frueh,Thomas;Pitterna,Thomas;Iwasaki,Genji;Oda,Kyoko;Yamamura,Takaki;Hayakawa,Kenji[BioorganicandMedicinalChemistryLetters,1998,vol.8,#16,p.2241-2246]

[2]CurrentPatentAssignee:BRISTOL-MYERSSQUIBBCO-US2005/143381,2005,A1Locationinpatent:Page/Pagecolumn83

[3]CurrentPatentAssignee:NOVARTISAG;Novartis(w/oSandoz)-US5977075,1999,A

[4]CurrentPatentAssignee:Novartis(w/oSandoz);NOVARTISAG-US5780498,1998,A

[5]CurrentPatentAssignee:Novartis(w/oSandoz);NOVARTISAG-US5703106,1997,A

[1]Swain,ChristopherJ.;Teran,Ana;Maroto,Marta;Cabello,Angeles[BioorganicandMedicinalChemistryLetters,2006,vol.16,#23,p.6058-6062]

[1]Swain,ChristopherJ.;Teran,Ana;Maroto,Marta;Cabello,Angeles[BioorganicandMedicinalChemistryLetters,2006,vol.16,#23,p.6058-6062]

[2]Lin,Yang-i;Lang,Stanley,A.[JournalofOrganicChemistry,1980,vol.45,#24,p.4857-4860]

[3]CurrentPatentAssignee:Novartis(w/oSandoz);NOVARTISAG-US5703106,1997,A

Literature
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SDS
Tags:7064-35-9 Molecular Formula|7064-35-9 MDL|7064-35-9 SMILES|7064-35-9 5-(4-Methylphenyl)isoxazole