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13536-21-5,MFCD02625844
Catalog No.:AA006YY4

13536-21-5 | 2-(Benzylsulfonyl)benzoic acid

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1g
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA006YY4
Chemical Name:
2-(Benzylsulfonyl)benzoic acid
CAS Number:
13536-21-5
Molecular Formula:
C14H12O4S
Molecular Weight:
276.3077
MDL Number:
MFCD02625844
SMILES:
OC(=O)c1ccccc1S(=O)(=O)Cc1ccccc1
Properties
Computed Properties
 
Complexity:
404  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
4  
XLogP3:
2.2  

Downstream Synthesis Route

[1]Cohen;Smiles[JournaloftheChemicalSociety,1930,p.406,410]

[1]Lombardino,J.G.;Wiseman,E.H.[JournalofMedicinalChemistry,1970,vol.13,p.206-210]

[1]Cohen;Smiles[JournaloftheChemicalSociety,1930,p.406,410]

[1]Lombardino,J.G.;Wiseman,E.H.[JournalofMedicinalChemistry,1970,vol.13,p.206-210]

[1]Lombardino,J.G.;Wiseman,E.H.[JournalofMedicinalChemistry,1970,vol.13,p.206-210]

Literature

Title: Microsphere-based protease assays and screening application for lethal factor and factor Xa.

Journal: Cytometry. Part A : the journal of the International Society for Analytical Cytology 20060501

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