Salicyloylaminotriazole

Base Information

• Chemical Name: Salicyloylaminotriazole
• CAS No.: 36411-52-6
• Deprecated CAS: 106803-52-5
• Molecular Formula: C9H8 N4 O2
• Molecular Weight: 204.188
• Hs Code.: 2933990090
• European Community (EC) Number: 253-021-4
• NSC Number: 332171
• UNII: ZFV6FN7NKV
• DSSTox Substance ID: DTXSID5052040
• Nikkaji Number: J57.998J
• Wikidata: Q72481986
• ChEMBL ID: CHEMBL1333085
• Mol file: 36411-52-6.mol

Synonyms:3-(N-salicyloyl)amino-1,2,4-triazole

Chemical Property of Salicyloylaminotriazole

Chemical Property:

• Vapor Pressure: 0.004Pa at 25℃
• Melting Point: 275-276 ºC
• Boiling Point: °Cat760mmHg
• PKA: 7.99±0.30(Predicted)
• Flash Point: °C
• PSA: 90.90000
• Density: 1.552
• LogP: 0.83560
• Storage Temp.: -20°C Freezer
• Solubility.: DMSO (Slightly)
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 204.06472551
• Heavy Atom Count: 15
• Complexity: 236

Purity/Quality:

99.9% ^*data from raw suppliers

3-(Salicyloylamino)-1,2,4-triazole ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C(=C1)C(=O)NC2=NC=NN2)O

Technology Process of Salicyloylaminotriazole

There total 1 articles about Salicyloylaminotriazole which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

3(5)-amino-1,2,4-triazole (61-82-5) + phenyl Salicylate (118-55-8) → 2-hydroxy-N-1H-1,2,4-triazol-3-ylbenzamide (36411-52-6)

Guidance literature:

at 210 ℃; for 1.5h;

upstream raw materials:

3⁽⁵⁾-amino-1,2,4-triazole

phenyl Salicylate

Refernces