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Home Fluorides 76480-99-4
76480-99-4,MFCD11504943
Catalog No.:AA005KWC

76480-99-4 | 5-(Trifluoromethyl)-1H-pyrazol-3(2H)-one

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$79.00   $55.00
- +
5g
98%
in stock  
$195.00   $137.00
- +
10g
98%
in stock  
$311.00   $218.00
- +
25g
98%
in stock  
$569.00   $398.00
- +
100g
98%
in stock  
$1,407.00   $985.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA005KWC
Chemical Name:
5-(Trifluoromethyl)-1H-pyrazol-3(2H)-one
CAS Number:
76480-99-4
Molecular Formula:
C4H3F3N2O
Molecular Weight:
152.0746
MDL Number:
MFCD11504943
SMILES:
FC(c1cc([nH]n1)O)(F)F
Properties
Properties
 
Form:
Solid  
MP:
205-208℃  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
195  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
10  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
2  
XLogP3:
0.6  

Downstream Synthesis Route

[1]Hu,Qiao-Sheng;Guan,Hui-Ping;Hu,Chang-Ming[JournalofFluorineChemistry,1995,vol.75,#1,p.51-54]

[1]Hu,Qiao-Sheng;Guan,Hui-Ping;Hu,Chang-Ming[JournalofFluorineChemistry,1995,vol.75,#1,p.51-54]

3,3-Dichloro-4,4,4-trifluoro-butyricacidethylester 
  76480-99-4 

[1]Hu,Qiao-Sheng;Guan,Hui-Ping;Hu,Chang-Ming[JournalofFluorineChemistry,1995,vol.75,#1,p.51-54]

124-63-0    76480-99-4   
methanesulfonicacid5-trifluoromethyl-1<i>H</i>-pyrazol-3-ylester 

[1]Finkelstein;Strock[PesticideScience,1997,vol.50,#4,p.324-328]

3179-63-3    76480-99-4   
dimethyl-3-(5-trifluoromethyl-1<i>H</i>-pyrazol-3-yloxy)-propyl-amine 

[1]Selwood;Brummell;Budworth;Burtin;Campbell;Chana;Charles;Fernandez;Glen;Goggin;Hobbs;Kling;Liu;Madge;Meillerais;Powell;Reynolds;Spacey;Stables;Tatlock;Wheeler;Wishart;Woo[JournalofMedicinalChemistry,2001,vol.44,#1,p.78-93]

Literature

Title: Spectral and thermal studies on ruthenium carbonyl complexes with 5-trifluoromethyl-2,4-dihydropyrazol-3-one ligands.

Journal: Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy 20070701

Title: Synthesis and antitumor activity of 5-trifluoromethyl-2,4- dihydropyrazol-3-one nucleosides.

Journal: Molecules (Basel, Switzerland) 20040227

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