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21172-43-0,MFCD27947302
Catalog No.:AA00BF1A

21172-43-0 | Methanesulfonic acid 3-(3-trifluoroMethylphenyl)propyl ester

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100mg
95%
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$80.00   $56.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00BF1A
Chemical Name:
Methanesulfonic acid 3-(3-trifluoroMethylphenyl)propyl ester
CAS Number:
21172-43-0
Molecular Formula:
C11H13F3O3S
Molecular Weight:
282.2793
MDL Number:
MFCD27947302
SMILES:
CS(=O)(=O)OCCCc1cccc(c1)C(F)(F)F
Properties
Computed Properties
 
Complexity:
346  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
18  
Hydrogen Bond Acceptor Count:
6  
Rotatable Bond Count:
5  
XLogP3:
2.8  

Downstream Synthesis Route

[1]Patent:CN106543008,2017,A.Locationinpatent:Paragraph0036;0037;0038;0039

[2]Patent:CN107473993,2017,A.Locationinpatent:Paragraph0022;0023;0025;0027

[3]Patent:WO2010/100429,2010,A1.Locationinpatent:Page/Pagecolumn19-20

[4]Journalofmedicinalchemistry,1968,vol.11,p.1258-1262

[5]Patent:US6559172,2003,B1

[6]Patent:WO2010/4588,2010,A2.Locationinpatent:Page/Pagecolumn39

[7]Patent:US2011/172455,2011,A1.Locationinpatent:Page/Pagecolumn19

[8]AngewandteChemie-InternationalEdition,2016,vol.55,p.15797-15801    Angew.Chem.,2016,vol.128,p.16029-16033,5

[9]Patent:CN109096119,2018,A.Locationinpatent:Paragraph0031-0036

[10]Patent:CN109928881,2019,A.Locationinpatent:Paragraph0059-0061

[1]Journalofmedicinalchemistry,1968,vol.11,p.1258-1262

[1]Patent:WO2008/63645,2008,A1.Locationinpatent:Page/Pagecolumn9

[2]Patent:WO2008/63645,2008,A1.Locationinpatent:Page/Pagecolumn14

[3]Patent:WO2008/63645,2008,A1.Locationinpatent:Page/Pagecolumn12,15-17

[4]Patent:WO2008/63645,2008,A1.Locationinpatent:Page/Pagecolumn13

[5]Patent:WO2008/63645,2008,A1.Locationinpatent:Page/Pagecolumn10-11

[6]Patent:WO2010/100429,2010,A1.Locationinpatent:Page/Pagecolumn21

[7]Patent:CN109928881,2019,A.Locationinpatent:Paragraph0062-0064

[1]Patent:WO2010/4588,2010,A2.Locationinpatent:Page/Pagecolumn40

[2]Patent:US2011/172455,2011,A1.Locationinpatent:Page/Pagecolumn20

[1]Patent:WO2010/100429,2010,A1.Locationinpatent:Page/Pagecolumn20-21

Literature
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SDS
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Tags:21172-43-0 Molecular Formula|21172-43-0 MDL|21172-43-0 SMILES|21172-43-0 Methanesulfonic acid 3-(3-trifluoroMethylphenyl)propyl ester