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90396-00-2,MFCD00278360
Catalog No.:AA006QK0

90396-00-2 | 3-(4-Chloro-benzenesulfonyl)-propionic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
98%
in stock  
$95.00   $67.00
- +
1g
98%
in stock  
$228.00   $160.00
- +
5g
98%
in stock  
$544.00   $381.00
- +
10g
98%
in stock  
$859.00   $602.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA006QK0
Chemical Name:
3-(4-Chloro-benzenesulfonyl)-propionic acid
CAS Number:
90396-00-2
Molecular Formula:
C9H9ClO4S
Molecular Weight:
248.6834
MDL Number:
MFCD00278360
SMILES:
OC(=O)CCS(=O)(=O)c1ccc(cc1)Cl
Properties
Computed Properties
 
Complexity:
312  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
4  
XLogP3:
1.3  

Downstream Synthesis Route

[1]Greshametal.[JournaloftheAmericanChemicalSociety,1952,vol.74,p.1323]

[1]Abdel-Wahab,Aboel-MagdA.;El-Khawaga,AhmedM.;El-Zohry,MaherF.;Khalaf,AliA.[PhosphorusandSulfurandtheRelatedElements,1984,vol.19,p.31-44]

[2]Kresze,G.etal.[ChemischeBerichte,1961,vol.94,p.2060-2072]

[1]Abdel-Wahab,Aboel-MagdA.;El-Khawaga,AhmedM.;El-Zohry,MaherF.;Khalaf,AliA.[PhosphorusandSulfurandtheRelatedElements,1984,vol.19,p.31-44]

[1]Abdel-Wahab,Aboel-MagdA.;El-Khawaga,AhmedM.;El-Zohry,MaherF.;Khalaf,AliA.[PhosphorusandSulfurandtheRelatedElements,1984,vol.19,p.31-44]

Literature

Title: Synthesis and SAR studies of 1,4-benzoxazine MenB inhibitors: novel antibacterial agents against Mycobacterium tuberculosis.

Journal: Bioorganic & medicinal chemistry letters 20101101

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SDS
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