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21358-12-3,MFCD00519076
Catalog No.:AA00C249

21358-12-3 | 4-Allyl-5-benzyl-4h-1,2,4-triazole-3-thiol

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1g
95%
in stock  
$172.00   $120.00
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5g
95%
in stock  
$685.00   $479.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00C249
Chemical Name:
4-Allyl-5-benzyl-4h-1,2,4-triazole-3-thiol
CAS Number:
21358-12-3
Molecular Formula:
C12H13N3S
Molecular Weight:
231.3167
MDL Number:
MFCD00519076
SMILES:
C=CCn1c(nnc1S)Cc1ccccc1
Properties
Computed Properties
 
Complexity:
305  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
2  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
4  
XLogP3:
2.2  

Downstream Synthesis Route
Ni(II)-(S)-BPB-D-Ala 
  21358-12-3    1346957-88-7    96293-17-3 

[1]TetrahedronAsymmetry,2012,vol.23,p.891-897

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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SDS
Tags:21358-12-3 Molecular Formula|21358-12-3 MDL|21358-12-3 SMILES|21358-12-3 4-Allyl-5-benzyl-4h-1,2,4-triazole-3-thiol