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Home Other Building Blocks 4455-09-8
4455-09-8,MFCD00059322
Catalog No.:AA003TIL

4455-09-8 | p-Toluenesulfonic acid phenethyl ester

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$9.00   $7.00
- +
5g
98%
in stock  
$24.00   $17.00
- +
100g
98%
in stock  
$319.00   $224.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA003TIL
Chemical Name:
p-Toluenesulfonic acid phenethyl ester
CAS Number:
4455-09-8
Molecular Formula:
C15H16O3S
Molecular Weight:
276.3507
MDL Number:
MFCD00059322
SMILES:
Cc1ccc(cc1)S(=O)(=O)OCCc1ccccc1
NSC Number:
142250
Properties
Properties
 
BP:
428.7°C at 760 mmHg  
Form:
Solid  
MP:
78 °C  
Storage:
Inert atmosphere;2-8℃;  

Computed Properties
 
Complexity:
344  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
3  
Rotatable Bond Count:
5  
XLogP3:
3.4  

Downstream Synthesis Route

[1]JournaloftheAmericanChemicalSociety,1956,vol.78,p.4045,4048

[1]Tetrahedron,1959,vol.7,p.206,212

[1]JournaloftheAmericanChemicalSociety,2012,vol.134,p.11408-11411

[2]Patent:WO2018/81814,2018,A1.Locationinpatent:Paragraph0128

[3]Synlett,2007,p.2501-2504

[4]JournaloftheAmericanChemicalSociety,2002,vol.124,p.3578-3585

[5]OrganicLetters,1999,vol.1,p.447-450

[6]NewJournalofChemistry,2017,vol.41,p.4743-4746

[7]Patent:CN106146475,2016,A.Locationinpatent:Paragraph0550;0551

[8]Patent:CN106083830,2016,A.Locationinpatent:Paragraph0552;0553

[9]Patent:US6750348,2004,B1.Locationinpatent:Pagecolumn80

[10]Patent:US2002/151546,2002,A1

[11]Patent:US2009/156615,2009,A1.Locationinpatent:Page/Pagecolumn18-19

[12]JournaloftheAmericanChemicalSociety,1957,vol.79,p.3710

[13]JournaloftheChemicalSociety,1963,p.366-373

[14]JournaloftheAmericanChemicalSociety,1981,vol.103,p.5423-5429

[15]CanadianJournalofChemistry,1987,vol.65,p.2149-2153

[16]SyntheticCommunications,2002,vol.32,p.2651-2655

[17]TetrahedronAsymmetry,2010,vol.21,p.325-332

[18]JournalofMedicinalChemistry,2013,vol.56,p.8543-8560

[19]InorganicChemistry,2014,vol.53,p.11467-11483

[20]JournaloftheAmericanChemicalSociety,2015,vol.137,p.5686-5694

[21]Chemistry-AEuropeanJournal,2014,vol.20,p.15334-15338

[22]Patent:WO2017/58716,2017,A1.Locationinpatent:Paragraph00272

[23]ChemicalCommunications,2017,vol.53,p.11584-11587

[24]ACSChemicalBiology,2017,vol.12,p.244-253

[25]Patent:CN108285439,2018,A.Locationinpatent:Paragraph0038;0131-0134

[1]JournalofMedicinalChemistry,1966,vol.9,p.391-394

[1]JournaloftheAmericanChemicalSociety,1973,vol.95,p.7777-7782

Literature
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SDS
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