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618070-50-1,MFCD03933290
Catalog No.:AA00EGXP

618070-50-1 | Ethyl 3-(4-bromophenyl)-1-methyl-1h-pyrazole-5-carboxylate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$222.00   $155.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00EGXP
Chemical Name:
Ethyl 3-(4-bromophenyl)-1-methyl-1h-pyrazole-5-carboxylate
CAS Number:
618070-50-1
Molecular Formula:
C13H13BrN2O2
Molecular Weight:
309.1585
MDL Number:
MFCD03933290
SMILES:
CCOC(=O)c1cc(nn1C)c1ccc(cc1)Br
Properties
Computed Properties
 
Complexity:
293  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
3  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
4  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
3.1  

Downstream Synthesis Route
618070-50-1   
C13H12Br2N2O2 

[1]Li,Guo;Kakarla,Ramesh;Gerritz,SamuelW.[TetrahedronLetters,2007,vol.48,#26,p.4595-4599]

[1]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-WO2005/49578,2005,A1Locationinpatent:Page/Pagecolumn63-64

618070-50-1   
C11H8BrN2O2(1-)*Na(1+) 

[1]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-WO2005/49578,2005,A1Locationinpatent:Page/Pagecolumn74-75

[1]CurrentPatentAssignee:BASFSE-WO2020/83733,2020,A1Locationinpatent:Page/Pagecolumn148

Literature
Quotation Request
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SDS
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Tags:618070-50-1 Molecular Formula|618070-50-1 MDL|618070-50-1 SMILES|618070-50-1 Ethyl 3-(4-bromophenyl)-1-methyl-1h-pyrazole-5-carboxylate
Catalog No.: AA00EGXP
618070-50-1,MFCD03933290
618070-50-1 | Ethyl 3-(4-bromophenyl)-1-methyl-1h-pyrazole-5-carboxylate
Pack Size： 250mg
Purity： 95%
in stock
$222.00 $155.00
Quantity
- +
Add to Card
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bulk Quotation Request
Technical Information
Catalog Number: AA00EGXP
Chemical Name: Ethyl 3-(4-bromophenyl)-1-methyl-1h-pyrazole-5-carboxylate
CAS Number: 618070-50-1
Molecular Formula: C13H13BrN2O2
Molecular Weight: 309.1585
MDL Number: MFCD03933290
SMILES: CCOC(=O)c1cc(nn1C)c1ccc(cc1)Br
Properties
Complexity: 293  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 18  
Hydrogen Bond Acceptor Count: 3  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 4  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 3.1  
Downstream Synthesis Route
618070-50-1   
C13H12Br2N2O2 

[1]Li,Guo;Kakarla,Ramesh;Gerritz,SamuelW.[TetrahedronLetters,2007,vol.48,#26,p.4595-4599]

40155-54-2    60-34-4    618070-50-1    852815-31-7 

[1]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-WO2005/49578,2005,A1Locationinpatent:Page/Pagecolumn63-64

618070-50-1   
C11H8BrN2O2(1-)*Na(1+) 

[1]CurrentPatentAssignee:GLAXOSMITHKLINEPLC-WO2005/49578,2005,A1Locationinpatent:Page/Pagecolumn74-75

40155-54-2    60-34-4    618070-50-1 

[1]CurrentPatentAssignee:BASFSE-WO2020/83733,2020,A1Locationinpatent:Page/Pagecolumn148

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