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Home Other Building Blocks 870196-80-8
870196-80-8,MFCD11040288
Catalog No.:AA003L64

870196-80-8 | 4-Cyano-4-(dodecylsulfanylthiocarbonyl)sulfanylpentanoic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
95%
in stock  
$39.00   $27.00
- +
1g
95%
in stock  
$62.00   $44.00
- +
5g
95%
in stock  
$95.00   $67.00
- +
100g
95%
in stock  
$1,750.00   $1,225.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003L64
Chemical Name:
4-Cyano-4-(dodecylsulfanylthiocarbonyl)sulfanylpentanoic acid
CAS Number:
870196-80-8
Molecular Formula:
C19H33NO2S3
Molecular Weight:
403.6658
MDL Number:
MFCD11040288
SMILES:
CCCCCCCCCCCCSC(=S)SC(CCC(=O)O)(C#N)C
Properties
Properties
 
Form:
Solid  
MP:
59-62°C  
Stability:
light sensitive  
Storage:
Keep in dry area;-20 ℃;  

Computed Properties
 
Complexity:
434  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
25  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
17  
Undefined Atom Stereocenter Count:
1  
XLogP3:
7.6  

Downstream Synthesis Route
870196-80-8    74-88-4   
methyl4-cyano-4-(dodecylsulfanythiocarbonyl)sulfanylpentanoate 

[1]CurrentPatentAssignee:DUPONTDENEMOURSINC-WO2005/113493,2005,A1Locationinpatent:Page/Pagecolumn3;5

870196-80-8    107-30-2   
C21H37NO3S3 

[1]CurrentPatentAssignee:DUPONTDENEMOURSINC-WO2005/113493,2005,A1Locationinpatent:Page/Pagecolumn6

[1]CurrentPatentAssignee:DUPONTDENEMOURSINC-WO2005/113493,2005,A1Locationinpatent:Page/Pagecolumn3;4-5

[2]Zhao,Yongmei;Houston,ZacharyH.;Simpson,JoshuaD.;Chen,Liyu;Fletcher,NicholasL.;Fuchs,AdrianV.;Blakey,Idriss;Thurecht,KristoferJ.[MolecularPharmaceutics,2017,vol.14,#10,p.3539-3549]

[3]Zhang,Dapeng;Fan,Yujiao;Chen,Hui;Trépout,Sylvain;Li,Min-Hui[AngewandteChemie-InternationalEdition,2019,vol.58,#30,p.10260-10265][Angew.Chem.,2019,vol.131,#30,p.10366-10371,6]

[4]Ponnusamy,Kannukaran;Babu,RajendranPrakash;Dhamodharan,Raghavachari[JournalofPolymerScience,PartA:PolymerChemistry,2013,vol.51,#5,p.1066-1078]

[5]Dhara,Dibakar;Dhara,Santanu;Maiti,Saikat;Maity,Pritiprasanna;Poddar,Puja;Sahoo,Satyagopal[ReactiveandFunctionalPolymers,2020,vol.154]

870196-80-8    1200959-54-1   
C37H49BNO2PS3 

[1]Locationinpatent:schemeortablePoetzsch,Robert;Fleischmann,Sven;Tock,Christian;Komber,Hartmut;Voit,BrigitteI.[Macromolecules,2011,vol.44,#9,p.3260-3269]

[1]Locationinpatent:experimentalpartPoetzsch,Robert;Fleischmann,Sven;Tock,Christian;Komber,Hartmut;Voit,BrigitteI.[Macromolecules,2011,vol.44,#9,p.3260-3269]

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Tags:870196-80-8 Molecular Formula|870196-80-8 MDL|870196-80-8 SMILES|870196-80-8 4-Cyano-4-(dodecylsulfanylthiocarbonyl)sulfanylpentanoic acid