61413-67-0,MFCD29924218
Catalog No.:AA0034IU

61413-67-0 | Chloromethyl dodecanoate

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$77.00   $54.00
- +
1g
95%
in stock  
$100.00   $70.00
- +
5g
97%
in stock  
$138.00   $97.00
- +
25g
97%
in stock  
$463.00   $324.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA0034IU
Chemical Name:
Chloromethyl dodecanoate
CAS Number:
61413-67-0
Molecular Formula:
C13H25ClO2
Molecular Weight:
248.7894
MDL Number:
MFCD29924218
SMILES:
CCCCCCCCCCCC(=O)OCCl
Properties
Properties
 
Form:
Solid  
Storage:
Room Temperature;Keep in dry area;  

Computed Properties
 
Complexity:
160  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
12  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
6  

Downstream Synthesis Route
39799-77-4    61413-67-0   
1-methyl-4-imidazolin-2-one-3-methylenedodecanoate 

[1]JournalofPharmaceuticalSciences,1988,vol.77,p.967-971

[1]BioorganicandMedicinalChemistry,2006,vol.14,p.2569-2580

[2]Patent:WO2019/207460,2019,A1.Locationinpatent:Page/Pagecolumn11-12

[3]Patent:US10533015,2020,B1.Locationinpatent:Page/Pagecolumn115-116

39799-77-4    61413-67-0   
I-methyl-4-imidazolin-2-one-3-methylenedodecanoate 
 
1-Methyl-4-imidazolin-2-one-3-methylenedodecanoate 

[1]Patent:US4845233,1989,A

[1]Patent:US4160099,1979,A

[1]Pierrat,Philippe;Kereselidze,Dimitri;Wehrung,Patrick;Zuber,Guy;Pons,Francoise;Lebeau,Luc[PharmaceuticalResearch,2013,vol.30,#5,p.1362-1379]

Literature
Quotation Request
Company Name:
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Additional Info:
SDS
Tags:61413-67-0 Molecular Formula|61413-67-0 MDL|61413-67-0 SMILES|61413-67-0 Chloromethyl dodecanoate
Catalog No.: AA0034IU
61413-67-0,MFCD29924218
61413-67-0 | Chloromethyl dodecanoate
Pack Size: 250mg
Purity: 95%
in stock
$77.00 $54.00
Pack Size: 1g
Purity: 95%
in stock
$100.00 $70.00
Pack Size: 5g
Purity: 97%
in stock
$138.00 $97.00
Pack Size: 25g
Purity: 97%
in stock
$463.00 $324.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA0034IU
Chemical Name: Chloromethyl dodecanoate
CAS Number: 61413-67-0
Molecular Formula: C13H25ClO2
Molecular Weight: 248.7894
MDL Number: MFCD29924218
SMILES: CCCCCCCCCCCC(=O)OCCl
Properties
Form: Solid  
Storage: Room Temperature;Keep in dry area;  
Complexity: 160  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 16  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 12  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 6  
Downstream Synthesis Route
39799-77-4    61413-67-0   
1-methyl-4-imidazolin-2-one-3-methylenedodecanoate 

[1]JournalofPharmaceuticalSciences,1988,vol.77,p.967-971

143-07-7    49715-04-0    61413-67-0 

[1]BioorganicandMedicinalChemistry,2006,vol.14,p.2569-2580

[2]Patent:WO2019/207460,2019,A1.Locationinpatent:Page/Pagecolumn11-12

[3]Patent:US10533015,2020,B1.Locationinpatent:Page/Pagecolumn115-116

39799-77-4    61413-67-0   
I-methyl-4-imidazolin-2-one-3-methylenedodecanoate 
 
1-Methyl-4-imidazolin-2-one-3-methylenedodecanoate 

[1]Patent:US4845233,1989,A

6972-69-6    61413-67-0    71221-87-9 

[1]Patent:US4160099,1979,A

61413-67-0    4235-95-4    1421945-04-1 

[1]Pierrat,Philippe;Kereselidze,Dimitri;Wehrung,Patrick;Zuber,Guy;Pons,Francoise;Lebeau,Luc[PharmaceuticalResearch,2013,vol.30,#5,p.1362-1379]

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