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13578-51-3,MFCD00458591
Catalog No.:AA00HUBK

13578-51-3 | 1-(4-Methylphenylsulfonyl)-1,2,4-triazole

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1g
98%
in stock  
$24.00   $17.00
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5g
98%
in stock  
$62.00   $44.00
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10g
98%
in stock  
$95.00   $67.00
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25g
98%
in stock  
$178.00   $125.00
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100g
98%
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$527.00   $369.00
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  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Upstream Synthesis Route
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00HUBK
Chemical Name:
1-(4-Methylphenylsulfonyl)-1,2,4-triazole
CAS Number:
13578-51-3
Molecular Formula:
C9H9N3O2S
Molecular Weight:
223.2517
MDL Number:
MFCD00458591
SMILES:
Cc1ccc(cc1)S(=O)(=O)n1ncnc1
Properties
Computed Properties
 
Complexity:
304  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Rotatable Bond Count:
2  
XLogP3:
1.6  

Upstream Synthesis Route

[1]CarbohydrateResearch,2003,vol.338,#5,p.451-453

[2]JournalofOrganicChemistry,2010,vol.75,#8,p.2722-2725

[3]Patent:US2008/76933,2008,A1,.Locationinpatent:Page/Pagecolumn3-5

[4]Patent:EP1258480,2002,A1,.Locationinpatent:Page37

[5]JournalofChemicalResearch,2016,vol.40,#2,p.101-106

[1]Tetrahedron,2017,vol.73,#17,p.2504-2511

[1]OrganicandBiomolecularChemistry,2015,vol.14,#2,p.590-597

[1]PharmaceuticalChemistryJournal,2006,vol.40,#3,p.145-148

[1]NucleosidesandNucleotides,1997,vol.16,#7-9,p.1067-1071

Downstream Synthesis Route
6002-45-5    13578-51-3    62116-95-4   
C17H21O3PS2 

[1]PhosphorusandSulfurandtheRelatedElements,1980,vol.8,p.375-378

4923-86-8    13578-51-3    82220-42-6   
triazoliumtrifluoromethanesulfonate 

[1]ChemischeBerichte,1982,vol.115,p.1636-1643

[1]PhosphorusandSulfurandtheRelatedElements,1986,vol.26,p.321-326

[1]NucleosidesandNucleotides,1997,vol.16,p.1067-1071

13578-51-3   
5-(Toluene-4-sulfonyl)-1H-1,2,4triazole 

[1]Heterocycles,1998,vol.48,p.155-159

Literature

Title: Regioselective sulfonylation at O-2 of cyclomaltoheptaose with 1-(p-tolylsulfonyl)-(1H)-1,2,4-triazole.

Journal: Carbohydrate research 20030214

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SDS
Tags:13578-51-3 Molecular Formula|13578-51-3 MDL|13578-51-3 SMILES|13578-51-3 1-(4-Methylphenylsulfonyl)-1,2,4-triazole