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885017-82-3,MFCD17677464
Catalog No.:AA00IF1F

885017-82-3 | 4-Bromo-1-(4-chlorophenyl)pyrazole

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$139.00   $97.00
- +
5g
98%
in stock  
$393.00   $275.00
- +
10g
98%
in stock  
$678.00   $475.00
- +
25g
98%
in stock  
$1,345.00 $942.00
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00IF1F
Chemical Name:
4-Bromo-1-(4-chlorophenyl)pyrazole
CAS Number:
885017-82-3
Molecular Formula:
C9H6BrClN2
Molecular Weight:
257.5143
MDL Number:
MFCD17677464
SMILES:
Clc1ccc(cc1)n1ncc(c1)Br
Properties
Computed Properties
 
Complexity:
171  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
3.2  

Downstream Synthesis Route

[1]Locationinpatent:experimentalpartSuh,Jeehee;Kang,HeeSung;Kim,Ji-Eun;Yum,EulKgun[BulletinoftheKoreanChemicalSociety,2012,vol.33,#6,p.2067-2070]

2075-45-8    108-90-7    885017-82-3   
2-(4-bromo-1H-pyrazol-1-yl)chlorobenzene 

[1]Das,Somnath;Natarajan,Palani;König,Burkhard[Chemistry-AEuropeanJournal,2017,vol.23,#72,p.18161-18165]

[1]Huang,He;Lambert,TristanH.[AngewandteChemie-InternationalEdition,2020,vol.59,#2,p.658-662][Angew.Chem.,2020,vol.132,p.668-672,5]

[2]Burton,JonathanW.;Genovino,Julien;Lian,Yajing;Monck,Nat;Sheridan,Thomas;Yayla,HaticeG.[EuropeanJournalofOrganicChemistry,2020,vol.2020,#18,p.2766-2770]

[1]CurrentPatentAssignee:AKEBIATHERAPEUTICS,INC.-WO2022/36188,2022,A1Locationinpatent:Paragraph0931-0933

[2]CurrentPatentAssignee:AKEBIATHERAPEUTICS,INC.-WO2022/36188,2022,A1Locationinpatent:Paragraph0931-0933

Literature
Quotation Request
Company Name:
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Additional Info:
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SDS
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Tags:885017-82-3 Molecular Formula|885017-82-3 MDL|885017-82-3 SMILES|885017-82-3 4-Bromo-1-(4-chlorophenyl)pyrazole
Catalog No.: AA00IF1F
885017-82-3,MFCD17677464
885017-82-3 | 4-Bromo-1-(4-chlorophenyl)pyrazole
Pack Size： 1g
Purity： 98%
in stock
$139.00 $97.00
Pack Size： 5g
Purity： 98%
in stock
$393.00 $275.00
Pack Size： 10g
Purity： 98%
in stock
$678.00 $475.00
Pack Size： 25g
Purity： 98%
in stock
$1,345.00 $942.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00IF1F
Chemical Name: 4-Bromo-1-(4-chlorophenyl)pyrazole
CAS Number: 885017-82-3
Molecular Formula: C9H6BrClN2
Molecular Weight: 257.5143
MDL Number: MFCD17677464
SMILES: Clc1ccc(cc1)n1ncc(c1)Br
Properties
Complexity: 171  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 13  
Hydrogen Bond Acceptor Count: 1  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 3.2  
Downstream Synthesis Route
2075-45-8    637-87-6    885017-82-3 

[1]Locationinpatent:experimentalpartSuh,Jeehee;Kang,HeeSung;Kim,Ji-Eun;Yum,EulKgun[BulletinoftheKoreanChemicalSociety,2012,vol.33,#6,p.2067-2070]

2075-45-8    108-90-7    885017-82-3   
2-(4-bromo-1H-pyrazol-1-yl)chlorobenzene 

[1]Das,Somnath;Natarajan,Palani;König,Burkhard[Chemistry-AEuropeanJournal,2017,vol.23,#72,p.18161-18165]

2075-45-8    352-33-0    885017-82-3 

[1]Huang,He;Lambert,TristanH.[AngewandteChemie-InternationalEdition,2020,vol.59,#2,p.658-662][Angew.Chem.,2020,vol.132,p.668-672,5]

[2]Burton,JonathanW.;Genovino,Julien;Lian,Yajing;Monck,Nat;Sheridan,Thomas;Yayla,HaticeG.[EuropeanJournalofOrganicChemistry,2020,vol.2020,#18,p.2766-2770]

2075-45-8    1679-18-1    885017-82-3 

[1]CurrentPatentAssignee:AKEBIATHERAPEUTICS,INC.-WO2022/36188,2022,A1Locationinpatent:Paragraph0931-0933

[2]CurrentPatentAssignee:AKEBIATHERAPEUTICS,INC.-WO2022/36188,2022,A1Locationinpatent:Paragraph0931-0933

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