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588694-28-4,MFCD11128609
Catalog No.:AA00EJ1R

588694-28-4 | N-tert-Butyl-2-chloroisonicotinamide

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
97%
in stock  
$107.00   $75.00
- +
5g
97%
in stock  
$297.00   $208.00
- +
25g
97%
in stock  
$774.00 $542.00
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00EJ1R
Chemical Name:
N-tert-Butyl-2-chloroisonicotinamide
CAS Number:
588694-28-4
Molecular Formula:
C10H13ClN2O
Molecular Weight:
212.6760
MDL Number:
MFCD11128609
SMILES:
Clc1nccc(c1)C(=O)NC(C)(C)C
Properties
Properties
 
Form:
Solid  
MP:
97-98℃  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
213  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1.8  

Downstream Synthesis Route

[1]Pavlova;Mikhalev;Kon'shin;Vasilyuk;Kotegov[PharmaceuticalChemistryJournal,2002,vol.36,#8,p.425-427]

[1]Pavlova;Mikhalev;Kon'shin;Vasilyuk;Kotegov[PharmaceuticalChemistryJournal,2002,vol.36,#8,p.425-427]

[1]Hawad,Haçan;Bayh,Omar;Hoarau,Christophe;Trécourt,Francois;Quéguiner,Guy;Marsais,Francis[Tetrahedron,2008,vol.64,#14,p.3236-3245]

[1]Hawad,Haçan;Bayh,Omar;Hoarau,Christophe;Trécourt,Francois;Quéguiner,Guy;Marsais,Francis[Tetrahedron,2008,vol.64,#14,p.3236-3245]

[1]Hawad,Haçan;Bayh,Omar;Hoarau,Christophe;Trécourt,Francois;Quéguiner,Guy;Marsais,Francis[Tetrahedron,2008,vol.64,#14,p.3236-3245]

Literature
Quotation Request
Company Name:
*
Contact Person:
*
Email:
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Quantity Required:
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Additional Info:
Submit
SDS
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Tags:588694-28-4 Molecular Formula|588694-28-4 MDL|588694-28-4 SMILES|588694-28-4 N-tert-Butyl-2-chloroisonicotinamide
Catalog No.: AA00EJ1R
588694-28-4,MFCD11128609
588694-28-4 | N-tert-Butyl-2-chloroisonicotinamide
Pack Size： 1g
Purity： 97%
in stock
$107.00 $75.00
Pack Size： 5g
Purity： 97%
in stock
$297.00 $208.00
Pack Size： 25g
Purity： 97%
in stock
$774.00 $542.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00EJ1R
Chemical Name: N-tert-Butyl-2-chloroisonicotinamide
CAS Number: 588694-28-4
Molecular Formula: C10H13ClN2O
Molecular Weight: 212.6760
MDL Number: MFCD11128609
SMILES: Clc1nccc(c1)C(=O)NC(C)(C)C
Properties
Form: Solid  
MP: 97-98℃  
Storage: Keep in dry area;2-8℃;  
Complexity: 213  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 14  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1.8  
Downstream Synthesis Route
65287-34-5    75-64-9    588694-28-4 

[1]Pavlova;Mikhalev;Kon'shin;Vasilyuk;Kotegov[PharmaceuticalChemistryJournal,2002,vol.36,#8,p.425-427]

6313-54-8    588694-28-4 

[1]Pavlova;Mikhalev;Kon'shin;Vasilyuk;Kotegov[PharmaceuticalChemistryJournal,2002,vol.36,#8,p.425-427]

6313-54-8    75-64-9    588694-28-4 

[1]Hawad,Haçan;Bayh,Omar;Hoarau,Christophe;Trécourt,Francois;Quéguiner,Guy;Marsais,Francis[Tetrahedron,2008,vol.64,#14,p.3236-3245]

588694-28-4    1021464-10-7 

[1]Hawad,Haçan;Bayh,Omar;Hoarau,Christophe;Trécourt,Francois;Quéguiner,Guy;Marsais,Francis[Tetrahedron,2008,vol.64,#14,p.3236-3245]

588694-28-4    1021464-11-8 

[1]Hawad,Haçan;Bayh,Omar;Hoarau,Christophe;Trécourt,Francois;Quéguiner,Guy;Marsais,Francis[Tetrahedron,2008,vol.64,#14,p.3236-3245]

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