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Home Thiazoles 4767-00-4
4767-00-4,MFCD00022878
Catalog No.:AA003HXE

4767-00-4 | 3-(2-Benzothiazolylthio)propionic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
5g
98%
in stock  
$11.00   $8.00
- +
25g
98%
in stock  
$33.00   $23.00
- +
500g
>98.0%(T)
in stock  
$365.00   $256.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003HXE
Chemical Name:
3-(2-Benzothiazolylthio)propionic acid
CAS Number:
4767-00-4
Molecular Formula:
C10H9NO2S2
Molecular Weight:
239.3140
MDL Number:
MFCD00022878
SMILES:
OC(=O)CCSc1nc2c(s1)cccc2
NSC Number:
13122
Properties
Properties
 
BP:
442.7°C at 760 mmHg  
Form:
Solid  
MP:
149℃  
Storage:
Keep in dry area;Room Temperature;  

Computed Properties
 
Complexity:
238  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
4  
XLogP3:
1.8  

Downstream Synthesis Route

[1]CurrentPatentAssignee:DUPONTDENEMOURSINC-US2416052,1945,A

[1]CurrentPatentAssignee:RAYTHEONTECHNOLOGIESCORPORATION;CollinsAerospace(in:RaytheonTechnologies)-US2483416,1945,A

[1]Prilezhaeva,E.N.;Shmonina,L.I.[BulletinoftheAcademyofSciencesoftheUSSRDivisionofChemicalScience,1969,p.621-622][IzvestiyaAkademiiNaukSSSR,SeriyaKhimicheskaya,1969,p.693-694]

[1]Anan'eva,K.V.;Rozhkov,N.K.[ChemistryofHeterocyclicCompounds,1986,vol.22,#4,p.456-459][KhimiyaGeterotsiklicheskikhSoedinenii,1986,vol.22,#4,p.554-557]

[1]Anan'eva,K.V.;Rozhkova,N.K.[ChemistryofHeterocyclicCompounds,1986,vol.22,#5,p.564-567][KhimiyaGeterotsiklicheskikhSoedinenii,1986,vol.22,#5,p.688-690]

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: Decoys for docking.

Journal: Journal of medicinal chemistry 20050602

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SDS
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