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31794-45-3,MFCD05664887
Catalog No.:AA007ID2

31794-45-3 | 3-Oxo-3,4-dihydro-2h-1,4-benzoxazine-6-sulfonyl chloride

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
98%
in stock  
$33.00   $23.00
- +
1g
98%
in stock  
$61.00   $43.00
- +
5g
98%
in stock  
$234.00   $164.00
- +
25g
96%
in stock  
$929.00   $650.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA007ID2
Chemical Name:
3-Oxo-3,4-dihydro-2h-1,4-benzoxazine-6-sulfonyl chloride
CAS Number:
31794-45-3
Molecular Formula:
C8H6ClNO4S
Molecular Weight:
247.6555
MDL Number:
MFCD05664887
SMILES:
O=C1COc2c(N1)cc(cc2)S(=O)(=O)Cl
Properties
Computed Properties
 
Complexity:
363  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
0.9  

Downstream Synthesis Route

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-US2008/318941,2008,A1Locationinpatent:Page/Pagecolumn26

[2]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2009/23844,2009,A2Locationinpatent:Page/Pagecolumn117

[3]CurrentPatentAssignee:ROCHEHOLDINGAG-US2010/16297,2010,A1Locationinpatent:Page/Pagecolumn28

[4]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2010/21797,2010,A1Locationinpatent:Page/Pagecolumn81-82

[5]CurrentPatentAssignee:ROCHEHOLDINGAG-US2010/29629,2010,A1Locationinpatent:Page/Pagecolumn56-57

[6]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2010/24980,2010,A1Locationinpatent:Page/Pagecolumn100

[7]CurrentPatentAssignee:ROCHEHOLDINGAG-US2010/22581,2010,A1Locationinpatent:Page/Pagecolumn38-39

[8]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2007/98418,2007,A1Locationinpatent:Page/Pagecolumn134-135

[9]CurrentPatentAssignee:AGIOSPHARMACEUTICALSINC-WO2012/88314,2012,A1Locationinpatent:Page/Pagecolumn58;60

[10]CurrentPatentAssignee:AGIOSPHARMACEUTICALSINC-US9181231,2015,B2Locationinpatent:Page/Pagecolumn80;82

[11]CurrentPatentAssignee:PROGENRA-WO2010/114881,2010,A1Locationinpatent:Page/Pagecolumn111-112

[12]Techer,H.etal.[ComptesRendusdesSeancesdel'AcademiedesSciences,SerieC:SciencesChimiques,1970,vol.270,p.1601-1604]

[13]CurrentPatentAssignee:ROCHEHOLDINGAG-US2008/200471,2008,A1Locationinpatent:Page/Pagecolumn49;49-50

[1]ComptesRendusdesSeancesdel'AcademiedesSciences,SerieC:SciencesChimiques,1970,vol.270,p.1601-1604

2-(trans-4-aminocyclohexyl)ethanol 
  31794-45-3    337912-66-0   
C28H34F3N3O5S 

[1]Agai-Csongor,Eva;Nogradi,Katalin;Galambos,Janos;Vago,Istvan;Bielik,Attila;Magdo,Ildiko;Ignacz-Szendrei,Gyoergyi;Keseru,GyoergyMiklos;Greiner,Istvan;Laszlovszky,Istvan;BelaKiss,EvaSchmidt;JuditLaszy,KatalinSaghy;Gyertyan,Istvan;Zajer-Balazs,Maria;Gemesi,Larisza;Domany,Gyoergy[BioorganicandMedicinalChemistryLetters,2007,vol.17,#19,p.5340-5344]

Literature
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SDS
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Tags:31794-45-3 Molecular Formula|31794-45-3 MDL|31794-45-3 SMILES|31794-45-3 3-Oxo-3,4-dihydro-2h-1,4-benzoxazine-6-sulfonyl chloride