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59843-58-2,MFCD00111881
Catalog No.:AA00IAJH

59843-58-2 | 5-(4-Chlorophenyl)-1H-pyrazole

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Purity
Availability
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1g
95%
in stock  
$21.00   $15.00
- +
5g
95%
in stock  
$51.00   $36.00
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25g
95%
in stock  
$195.00   $137.00
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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:
AA00IAJH
Chemical Name:
5-(4-Chlorophenyl)-1H-pyrazole
CAS Number:
59843-58-2
Molecular Formula:
C9H7ClN2
Molecular Weight:
178.6183
MDL Number:
MFCD00111881
SMILES:
Clc1ccc(cc1)c1cc[nH]n1
Properties
Properties
 
BP:
366.4 °C at 760 mmHg  
Form:
Solid  
MP:
80 °C  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
144  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
2.5  

Downstream Synthesis Route

[1]IzvestiyaAkademiiNaukSSSR,SeriyaKhimicheskaya,1957,p.1181,1185;engl.Ausg.S.1206,1209

[1]JournaloftheChemicalSociety.PerkintransactionsI,1987,p.1945-1950

[2]JournaloftheChemicalSociety.PerkintransactionsI,1987,p.1945-1950

[1]Synthesis,1985,p.690-691

135641-68-8    59843-58-2    135641-71-3    135641-70-2   
5-p-chlorophenyl-1-methoxycarbonyl-1H-pyrazole 

[1]JournalofChemicalResearch,Miniprint,1991,p.1701-1757

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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SDS
Tags:59843-58-2 Molecular Formula|59843-58-2 MDL|59843-58-2 SMILES|59843-58-2 5-(4-Chlorophenyl)-1H-pyrazole |Halogenated_Heterocycles