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52188-11-1,MFCD00688358
Catalog No.:AA006VU5

52188-11-1 | (1,1-Dioxido-3-oxo-1,2-benzisothiazol-2(3h)-yl)acetic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
97%
in stock  
$112.00   $78.00
- +
5g
97%
in stock  
$353.00   $247.00
- +
10g
97%
in stock  
$660.00   $462.00
- +
25g
97%
in stock  
$1,308.00   $916.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA006VU5
Chemical Name:
(1,1-Dioxido-3-oxo-1,2-benzisothiazol-2(3h)-yl)acetic acid
CAS Number:
52188-11-1
Molecular Formula:
C9H7NO5S
Molecular Weight:
241.2206
MDL Number:
MFCD00688358
SMILES:
OC(=O)CN1C(=O)c2c(S1(=O)=O)cccc2
Properties
Properties
 
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
424  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
0.2  

Downstream Synthesis Route

[1]Pharmazie,2002,vol.57,p.384-392

[1]Pharmazie,2002,vol.57,p.384-392

[1]Locationinpatent:schemeortableWang,Jane;Limburg,David;Carter,Jeff;Mbalaviele,Gabriel;Gierse,James;Vazquez,Michael[BioorganicandMedicinalChemistryLetters,2010,vol.20,#5,p.1604-1609]

52188-11-1    538-51-2   
trans-2-(-2-oxo-1,4-diphenylazetidin-3-yl)benzodisothiazol-3(2H)-one-1,1-dioxide 

[1]Janssen,GuidoV.;vandenHeuvel,JoyceA.C.;Megens,RikP.;Benningshof,JorgC.J.;Ovaa,Huib[BioorganicandMedicinalChemistry,2018,vol.26,#1,p.41-49]

22179-78-8    52188-11-1   
2‐3‐(4‐fluorophenyl)‐1,2,4‐oxadiazol‐5‐ylmethyl}benzodisothiazol‐3(2H)‐one1,1‐dioxide 

[1]Angeli,Andrea;Arifuddin,Mohammed;Chinchilli,KrishnaK.;Danaboina,Srikanth;Nanduri,Srinivas;Royyala,VenkataN.;Singh,Priti;Supuran,ClaudiuT.;Thacker,PavitraS.[ArchivderPharmazie,2022]

Literature
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SDS
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Tags:52188-11-1 Molecular Formula|52188-11-1 MDL|52188-11-1 SMILES|52188-11-1 (1,1-Dioxido-3-oxo-1,2-benzisothiazol-2(3h)-yl)acetic acid