Home Aldehydes 87967-95-1
87967-95-1,MFCD02677714
Catalog No.:AA003MSV

87967-95-1 | 5-Methyl-3-phenyl-4-isoxazolecarbaldehyde

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250mg
98%
in stock  
$112.00   $78.00
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1g
≥ 98% (HPLC)
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$132.00   $93.00
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5g
≥ 98% (HPLC)
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$475.00   $333.00
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10g
≥ 98% (HPLC)
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$844.00   $591.00
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25g
≥ 98% (HPLC)
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$1,792.00   $1,255.00
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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:
AA003MSV
Chemical Name:
5-Methyl-3-phenyl-4-isoxazolecarbaldehyde
CAS Number:
87967-95-1
Molecular Formula:
C11H9NO2
Molecular Weight:
187.1947
MDL Number:
MFCD02677714
SMILES:
O=Cc1c(C)onc1c1ccccc1
Properties
Properties
 
BP:
110-112°C  
Form:
Solid  
MP:
41 °C  
Stability:
Light Sensitive  

Computed Properties
 
Complexity:
202  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
2  
XLogP3:
1.9  

Downstream Synthesis Route

[1]GazzettaChimicaItaliana,1938,vol.68,p.411,416

[1]ChemMedChem,2012,vol.7,p.425-439

[2]Patent:US2010/216845,2010,A1.Locationinpatent:Page/Pagecolumn11

[3]Patent:WO2010/127975,2010,A1.Locationinpatent:Page/Pagecolumn133;134

[4]Synthesis,1990,p.62-64

[5]SyntheticCommunications,1983,vol.13,p.817-822

[6]Synthesis,2003,p.1347-1356

[7]BioorganicandMedicinalChemistry,2017,vol.25,p.3223-3234

[1]Tetrahedron,2000,vol.56,p.4299-4309

[1]SyntheticCommunications,1983,vol.13,p.817-822

[2]Synthesis,1990,p.62-64

[3]ChemMedChem,2012,vol.7,p.425-439

[1]CurrentPatentAssignee:MERCK&COINC-US2004/6226,2004,A1Locationinpatent:Page8

Literature

Title: Discovery of substituted isoxazolecarbaldehydes as potent spermicides, acrosin inhibitors and mild anti-fungal agents.

Journal: Human reproduction (Oxford, England) 20050801

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SDS
Tags:87967-95-1 Molecular Formula|87967-95-1 MDL|87967-95-1 SMILES|87967-95-1 5-Methyl-3-phenyl-4-isoxazolecarbaldehyde |Heterocyclic_Building_Blocks