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160388-54-5,MFCD07187900
Catalog No.:AA001RT3

160388-54-5 | 4-(1H-1,2,4-Triazol-1-ylmethyl)benzoic acid hydrochloride

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Purity
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Price(USD)
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250mg
97%
1 week  
$162.00   $114.00
- +
1g
97%
1 week  
$330.00   $231.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA001RT3
Chemical Name:
4-(1H-1,2,4-Triazol-1-ylmethyl)benzoic acid hydrochloride
CAS Number:
160388-54-5
Molecular Formula:
C10H9N3O2
Molecular Weight:
203.1974
MDL Number:
MFCD07187900
SMILES:
OC(=O)c1ccc(cc1)Cn1ncnc1
Properties
Computed Properties
 
Complexity:
227  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
3  
XLogP3:
0.4  

Downstream Synthesis Route

[1]IlFarmaco,1994,vol.49,p.625-632

[1]IlFarmaco,1994,vol.49,p.625-632

[1]Patent:US2003/181496,2003,A1

7732-18-5    160388-54-5    10108-64-2   
polyμ2-aqua-μ2-chlorido-μ2-4-(1H-1,2,4-triazol-1-yl)methylbenzoatocadmium(II) 

[1]ActaCrystallographica,SectionC:CrystalStructureCommunications,2009,vol.65,p.m66-m68

Literature

Title: A novel two-dimensional framework based on unprecedented cadmium(II) chains.

Journal: Acta crystallographica. Section C, Crystal structure communications 20090201

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SDS
Tags:160388-54-5 Molecular Formula|160388-54-5 MDL|160388-54-5 SMILES|160388-54-5 4-(1H-1,2,4-Triazol-1-ylmethyl)benzoic acid hydrochloride