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223557-20-8,MFCD20441889
Catalog No.:AA006YNE

223557-20-8 | 1-Bromo-4-(propane-1-sulfonyl)benzene

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$43.00   $30.00
- +
5g
98%
in stock  
$107.00   $75.00
- +
25g
98%
in stock  
$250.00   $175.00
- +
100g
98%
in stock  
$567.00 $397.00
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA006YNE
Chemical Name:
1-Bromo-4-(propane-1-sulfonyl)benzene
CAS Number:
223557-20-8
Molecular Formula:
C9H11BrO2S
Molecular Weight:
263.1514
MDL Number:
MFCD20441889
SMILES:
CCCS(=O)(=O)c1ccc(cc1)Br
Properties
Computed Properties
 
Complexity:
235  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
3  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
2.7  

Downstream Synthesis Route
223557-20-8   
4-(propane-1-sulfonyl)-phenyl-hydrazine 

[1]Koenigs;Wylezich[JournalfurpraktischeChemie(Leipzig1954),1932,vol.<2>132,p.24,35]

[1]Koenigs;Wylezich[JournalfurpraktischeChemie(Leipzig1954),1931,vol.<2>132,p.24,25]

[1]Koenigs;Wylezich[JournalfurpraktischeChemie(Leipzig1954),1931,vol.<2>132,p.24,25]

[1]CurrentPatentAssignee:EISAICOLTD-US6340759,2002,B1Locationinpatent:Example451

[1]CurrentPatentAssignee:ELILILLY&CO-WO2006/19833,2006,A1Locationinpatent:Page/Pagecolumn54

[2]Locationinpatent:experimentalpartCharrier,Jean-Damien;Durrant,StevenJ.;Golec,JulianM.C.;Kay,DavidP.;Knegtel,RonaldM.A.;MacCormick,Somhairle;Mortimore,Michael;O'Donnell,MichaelE.;Pinder,JoanneL.;Reaper,PhilipM.;Rutherford,AlistairP.;Wang,PaulS.H.;Young,StephenC.;Pollard,JohnR.[JournalofMedicinalChemistry,2011,vol.54,#7,p.2320-2330]

Literature
Quotation Request
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SDS
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Tags:223557-20-8 Molecular Formula|223557-20-8 MDL|223557-20-8 SMILES|223557-20-8 1-Bromo-4-(propane-1-sulfonyl)benzene
Catalog No.: AA006YNE
223557-20-8,MFCD20441889
223557-20-8 | 1-Bromo-4-(propane-1-sulfonyl)benzene
Pack Size： 1g
Purity： 98%
in stock
$43.00 $30.00
Pack Size： 5g
Purity： 98%
in stock
$107.00 $75.00
Pack Size： 25g
Purity： 98%
in stock
$250.00 $175.00
Pack Size： 100g
Purity： 98%
in stock
$567.00 $397.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA006YNE
Chemical Name: 1-Bromo-4-(propane-1-sulfonyl)benzene
CAS Number: 223557-20-8
Molecular Formula: C9H11BrO2S
Molecular Weight: 263.1514
MDL Number: MFCD20441889
SMILES: CCCS(=O)(=O)c1ccc(cc1)Br
Properties
Complexity: 235  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 13  
Hydrogen Bond Acceptor Count: 2  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 3  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 2.7  
Downstream Synthesis Route
223557-20-8   
4-(propane-1-sulfonyl)-phenyl-hydrazine 

[1]Koenigs;Wylezich[JournalfurpraktischeChemie(Leipzig1954),1932,vol.<2>132,p.24,35]

106-94-5    106-53-6    223557-20-8 

[1]Koenigs;Wylezich[JournalfurpraktischeChemie(Leipzig1954),1931,vol.<2>132,p.24,25]

106-53-6    223557-20-8 

[1]Koenigs;Wylezich[JournalfurpraktischeChemie(Leipzig1954),1931,vol.<2>132,p.24,25]

223557-20-8    813-19-4    223555-38-2 

[1]CurrentPatentAssignee:EISAICOLTD-US6340759,2002,B1Locationinpatent:Example451

223557-20-8    73183-34-3    876617-07-1 

[1]CurrentPatentAssignee:ELILILLY&CO-WO2006/19833,2006,A1Locationinpatent:Page/Pagecolumn54

[2]Locationinpatent:experimentalpartCharrier,Jean-Damien;Durrant,StevenJ.;Golec,JulianM.C.;Kay,DavidP.;Knegtel,RonaldM.A.;MacCormick,Somhairle;Mortimore,Michael;O'Donnell,MichaelE.;Pinder,JoanneL.;Reaper,PhilipM.;Rutherford,AlistairP.;Wang,PaulS.H.;Young,StephenC.;Pollard,JohnR.[JournalofMedicinalChemistry,2011,vol.54,#7,p.2320-2330]

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