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Home  > Chemistry  > Heterocyclic Building Blocks  > Triazoles  > 2-[(4H-1,2,4-Triazol-3-ylthio)methyl]benzoic acid

AH15305

733795-49-8 | 2-[(4H-1,2,4-Triazol-3-ylthio)methyl]benzoic acid

Packsize Purity Availability Price Discounted Price    Quantity
1g 95% in stock $147.00 $103.00 -   +
5g 95% in stock $395.00 $277.00 -   +
10g 95% in stock $581.00 $407.00 -   +

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Description
Catalog Number: AH15305
Chemical Name: 2-[(4H-1,2,4-Triazol-3-ylthio)methyl]benzoic acid
CAS Number: 733795-49-8
Molecular Formula: C10H9N3O2S
Molecular Weight: 235.2624
MDL Number: MFCD04636902
SMILES: OC(=O)c1ccccc1CSc1nnc[nH]1

 

Computed Properties
Complexity: 252  
Covalently-Bonded Unit Count: 1  
Heavy Atom Count: 16  
Hydrogen Bond Acceptor Count: 5  
Hydrogen Bond Donor Count: 2  
Rotatable Bond Count: 4  
XLogP3: 1.9  

 

 

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