6004-24-6,MFCD00149977
Catalog No.:AA003EB3

6004-24-6 | Cetylpyridinium chloride monohydrate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
25g
>98.0%(T)(HPLC)
in stock  
$23.00   $16.00
- +
100g
>98.0%(T)(HPLC)
in stock  
$54.00   $38.00
- +
500g
>98.0%(T)(HPLC)
in stock  
$133.00   $93.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA003EB3
Chemical Name:
Cetylpyridinium chloride monohydrate
CAS Number:
6004-24-6
Molecular Formula:
C21H40ClNO
Molecular Weight:
358.0014
MDL Number:
MFCD00149977
SMILES:
CCCCCCCCCCCCCCCC[n+]1ccccc1.[Cl-].O
Properties
Properties
 
Form:
Solid  
MP:
81-84 °C  
Solubility:
H2O: soluble0.5M, clear, colorless to faintly yellow  
Storage:
Inert atmosphere;Room Temperature;  

Computed Properties
 
Complexity:
208  
Covalently-Bonded Unit Count:
3  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
24  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0  
Rotatable Bond Count:
15  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  

Downstream Synthesis Route
5K(1+)*IW6O24(5-)*6H2O=K5{IW6O24}*6H2O 
  6004-24-6   
4C5H5N(CH2)15CH3(1+)*K(1+)*IW6O24(5-)={C5H5N(CH2)15CH3}4K{IW6O24} 

[1]Dengel,AndrewC.;El-Hendawy,AhmedM.;Griffith,WilliamP.;Mostafa,SaharI.;Williams,DavidJ.[JournaloftheChemicalSociety,DaltonTransactions,1992,#24,p.3489-3496]

5K(1+)*IMo6O24(5-)*6H2O=K5{IMo6O24}*6H2O 
  6004-24-6   
4C5H5N(CH2)15CH3(1+)*K(1+)*IMo6O24(5-)={C5H5N(CH2)15CH3}4K{IMo6O24} 

[1]Dengel,AndrewC.;El-Hendawy,AhmedM.;Griffith,WilliamP.;Mostafa,SaharI.;Williams,DavidJ.[JournaloftheChemicalSociety,DaltonTransactions,1992,#24,p.3489-3496]

molybdophosphoricacidhydrate 
  6004-24-6   
π-C5H5N(+)(CH2)15CH33(PMo12O40)(3-) 

[1]Siozaki,Ryuji;Inagaki,Atushi;Kominami,Hiroshi;Yamaguchi,Shunro;Ichihara,Junko;Kera,Yoshiya[JournalofMolecularCatalysisA:Chemical,1997,vol.124,#1,p.29-37]

tungstophosphoricacid*15.4H2O 
  6004-24-6    7722-84-1   
tris(N-hexadecylpyridinium)tetrakis(oxodiperoxotungsto)phosphate 

[1]Pai;Tolstikov;Berdnikova;Kustova;Khlebnikova;Selivanova;Shangina;Kostrovskii[RussianChemicalBulletin,2005,vol.54,#8,p.1847-1854]

dodecatungstophosphoricacidhydrate 
  6004-24-6   
tris(cetylpyridinium)12-tungstophosphate 

[1]Siozaki,Ryuji;Inagaki,Atushi;Kominami,Hiroshi;Yamaguchi,Shunro;Ichihara,Junko;Kera,Yoshiya[JournalofMolecularCatalysisA:Chemical,1997,vol.124,#1,p.29-37]

[2]Kera;Yamaguchi;Inagaki;Ichihara;Mochizuki;Kominami[JournalofMolecularCatalysisA:Chemical,2002,vol.184,#1-2,p.413-429]

Literature

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

Title: Datta S, et al. In Vitro Evaluation of Mitochondrial Function and Estrogen Signaling in Cell Lines Exposed to the Antiseptic Cetylpyridinium Chloride. Environ Health Perspect. 2017 Aug 22;125(8):087015.

Title: Popkin DL, et al. Cetylpyridinium Chloride (CPC) Exhibits Potent, Rapid Activity Against Influenza Viruses in vitro and in vivo. Pathog Immun. 2017;2(2):252-269.

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Additional Info:
SDS
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Tags:6004-24-6 Molecular Formula|6004-24-6 MDL|6004-24-6 SMILES|6004-24-6 Cetylpyridinium chloride monohydrate
Catalog No.: AA003EB3
6004-24-6,MFCD00149977
6004-24-6 | Cetylpyridinium chloride monohydrate
Pack Size: 25g
Purity: >98.0%(T)(HPLC)
in stock
$23.00 $16.00
Pack Size: 100g
Purity: >98.0%(T)(HPLC)
in stock
$54.00 $38.00
Pack Size: 500g
Purity: >98.0%(T)(HPLC)
in stock
$133.00 $93.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA003EB3
Chemical Name: Cetylpyridinium chloride monohydrate
CAS Number: 6004-24-6
Molecular Formula: C21H40ClNO
Molecular Weight: 358.0014
MDL Number: MFCD00149977
SMILES: CCCCCCCCCCCCCCCC[n+]1ccccc1.[Cl-].O
Properties
Form: Solid  
MP: 81-84 °C  
Solubility: H2O: soluble0.5M, clear, colorless to faintly yellow  
Storage: Inert atmosphere;Room Temperature;  
Complexity: 208  
Covalently-Bonded Unit Count: 3  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 24  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 1  
Isotope Atom Count: 0  
Rotatable Bond Count: 15  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
Downstream Synthesis Route
5K(1+)*IW6O24(5-)*6H2O=K5{IW6O24}*6H2O 
  6004-24-6   
4C5H5N(CH2)15CH3(1+)*K(1+)*IW6O24(5-)={C5H5N(CH2)15CH3}4K{IW6O24} 

[1]Dengel,AndrewC.;El-Hendawy,AhmedM.;Griffith,WilliamP.;Mostafa,SaharI.;Williams,DavidJ.[JournaloftheChemicalSociety,DaltonTransactions,1992,#24,p.3489-3496]

5K(1+)*IMo6O24(5-)*6H2O=K5{IMo6O24}*6H2O 
  6004-24-6   
4C5H5N(CH2)15CH3(1+)*K(1+)*IMo6O24(5-)={C5H5N(CH2)15CH3}4K{IMo6O24} 

[1]Dengel,AndrewC.;El-Hendawy,AhmedM.;Griffith,WilliamP.;Mostafa,SaharI.;Williams,DavidJ.[JournaloftheChemicalSociety,DaltonTransactions,1992,#24,p.3489-3496]

molybdophosphoricacidhydrate 
  6004-24-6   
π-C5H5N(+)(CH2)15CH33(PMo12O40)(3-) 

[1]Siozaki,Ryuji;Inagaki,Atushi;Kominami,Hiroshi;Yamaguchi,Shunro;Ichihara,Junko;Kera,Yoshiya[JournalofMolecularCatalysisA:Chemical,1997,vol.124,#1,p.29-37]

tungstophosphoricacid*15.4H2O 
  6004-24-6    7722-84-1   
tris(N-hexadecylpyridinium)tetrakis(oxodiperoxotungsto)phosphate 

[1]Pai;Tolstikov;Berdnikova;Kustova;Khlebnikova;Selivanova;Shangina;Kostrovskii[RussianChemicalBulletin,2005,vol.54,#8,p.1847-1854]

dodecatungstophosphoricacidhydrate 
  6004-24-6   
tris(cetylpyridinium)12-tungstophosphate 

[1]Siozaki,Ryuji;Inagaki,Atushi;Kominami,Hiroshi;Yamaguchi,Shunro;Ichihara,Junko;Kera,Yoshiya[JournalofMolecularCatalysisA:Chemical,1997,vol.124,#1,p.29-37]

[2]Kera;Yamaguchi;Inagaki;Ichihara;Mochizuki;Kominami[JournalofMolecularCatalysisA:Chemical,2002,vol.184,#1-2,p.413-429]

Literature fold

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 Cytology20060501

Title: Datta S, et al. In Vitro Evaluation of Mitochondrial Function and Estrogen Signaling in Cell Lines Exposed to the Antiseptic Cetylpyridinium Chloride. Environ Health Perspect. 2017 Aug 22;125(8):087015.

Title: Popkin DL, et al. Cetylpyridinium Chloride (CPC) Exhibits Potent, Rapid Activity Against Influenza Viruses in vitro and in vivo. Pathog Immun. 2017;2(2):252-269.

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