82633-69-0,MFCD00155841
Catalog No.:AA00G43K

82633-69-0 | 5-Methyl-4-nitro-3-(perfluoropropyl)-1H-pyrazole

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
in stock  
$72.00   $50.00
- +
1g
in stock  
$143.00   $100.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00G43K
Chemical Name:
5-Methyl-4-nitro-3-(perfluoropropyl)-1H-pyrazole
CAS Number:
82633-69-0
Molecular Formula:
C7H4F7N3O2
Molecular Weight:
295.1144
MDL Number:
MFCD00155841
SMILES:
FC(C(C(F)(F)F)(F)F)(c1n[nH]c(c1[N+](=O)[O-])C)F
Properties
Computed Properties
 
Complexity:
367  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
10  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.7  

Downstream Synthesis Route

[1]Peglion,Jean-Louis;Pastor,Raphael;Greiner,Jaques;Cambon,Aime[BulletindelaSocieteChimiquedeFrance,1982,vol.2,#1-2,p.89-94]

[1]CurrentPatentAssignee:CHEMOCENTRYXINC-US2004/162282,2004,A1

[2]CurrentPatentAssignee:CHEMOCENTRYXINC-WO2003/105853,2003,A1Locationinpatent:Page69

82633-69-0    330601-48-4   
1-4-(4-fluoro-phenyl)-piperazin-1-yl-2-(3-hetpafluoropropyl-5-methyl-4-nitro-pyrazol-1-yl)-ethanone 

[1]CurrentPatentAssignee:CHEMOCENTRYXINC-US2004/162282,2004,A1

82633-69-0    60121-78-0   
1-4-(4-chloro-phenyl)-piperazin-1-yl-2-(3-hetpafluoropropyl-5-methyl-4-nitro-pyrazol-1-yl)-ethanone 

[1]CurrentPatentAssignee:CHEMOCENTRYXINC-US2004/162282,2004,A1

Literature
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Tags:82633-69-0 Molecular Formula|82633-69-0 MDL|82633-69-0 SMILES|82633-69-0 5-Methyl-4-nitro-3-(perfluoropropyl)-1H-pyrazole
Catalog No.: AA00G43K
82633-69-0,MFCD00155841
82633-69-0 | 5-Methyl-4-nitro-3-(perfluoropropyl)-1H-pyrazole
Pack Size: 250mg
Purity:
in stock
$72.00 $50.00
Pack Size: 1g
Purity:
in stock
$143.00 $100.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00G43K
Chemical Name: 5-Methyl-4-nitro-3-(perfluoropropyl)-1H-pyrazole
CAS Number: 82633-69-0
Molecular Formula: C7H4F7N3O2
Molecular Weight: 295.1144
MDL Number: MFCD00155841
SMILES: FC(C(C(F)(F)F)(F)F)(c1n[nH]c(c1[N+](=O)[O-])C)F
Properties
Complexity: 367  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 19  
Hydrogen Bond Acceptor Count: 10  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.7  
Downstream Synthesis Route
75823-64-2    82633-69-0 

[1]Peglion,Jean-Louis;Pastor,Raphael;Greiner,Jaques;Cambon,Aime[BulletindelaSocieteChimiquedeFrance,1982,vol.2,#1-2,p.89-94]

82633-69-0    637022-61-8 

[1]CurrentPatentAssignee:CHEMOCENTRYXINC-US2004/162282,2004,A1

[2]CurrentPatentAssignee:CHEMOCENTRYXINC-WO2003/105853,2003,A1Locationinpatent:Page69

82633-69-0    330601-48-4   
1-4-(4-fluoro-phenyl)-piperazin-1-yl-2-(3-hetpafluoropropyl-5-methyl-4-nitro-pyrazol-1-yl)-ethanone 

[1]CurrentPatentAssignee:CHEMOCENTRYXINC-US2004/162282,2004,A1

82633-69-0    60121-78-0   
1-4-(4-chloro-phenyl)-piperazin-1-yl-2-(3-hetpafluoropropyl-5-methyl-4-nitro-pyrazol-1-yl)-ethanone 

[1]CurrentPatentAssignee:CHEMOCENTRYXINC-US2004/162282,2004,A1

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