Bendazac

Base Information

• Chemical Name: Bendazac
• CAS No.: 20187-55-7
• Molecular Formula: C16H14N2O3
• Molecular Weight: 282.299
• Hs Code.: 2933990090
• European Community (EC) Number: 243-569-2
• UNII: G4AG71204O
• DSSTox Substance ID: DTXSID1048334
• Nikkaji Number: J3.148H
• Wikipedia: Bendazac
• Wikidata: Q862414
• NCI Thesaurus Code: C80537
• Metabolomics Workbench ID: 154303
• ChEMBL ID: CHEMBL1089221
• Mol file: 20187-55-7.mol

Synonyms:bendazac;bendazolic acid;bendazolic acid, sodium salt;bindazac

Chemical Property of Bendazac

Chemical Property:

• Appearance/Colour: white to off-white crystalline powder
• Vapor Pressure: 3.78E-11mmHg at 25°C
• Melting Point: 161-163 °C
• Refractive Index: 1.63
• Boiling Point: 508.151 °C at 760 mmHg
• PKA: 2.89±0.10(Predicted)
• Flash Point: 261.12 °C
• PSA: 64.35000
• Density: 1.276 g/cm³
• LogP: 2.54800
• Storage Temp.: Sealed in dry,Room Temperature
• Solubility.: DMSO (Slightly), Methanol (Slightly, Heated)
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 5
• Exact Mass: 282.10044231
• Heavy Atom Count: 21
• Complexity: 357

Purity/Quality:

99% ^*data from raw suppliers

Bendazac ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)CN2C3=CC=CC=C3C(=N2)OCC(=O)O
• Uses: Bendazac is a non-steroidal anti-inflammatory drug (NSAID). Bendazac is often used for joint and muscular pain. Bendazac has potential as an anti-denaturant drug for cataract and other condensation di seases as it protects proteins from denaturation induced by different agents.
• Therapeutic Function: Antiinflammatory

Technology Process of Bendazac

There total 1 articles about Bendazac 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:

→ bendazac (20187-55-7)

Guidance literature:

entspr. 3-Oxi-indazol, entspr. α-Br-Saeure, NaOH in H2O, 7 Std., 70grad;

Reference yield: 96.0%

methanol (67-56-1) + bendazac (20187-55-7) → methyl 2-((1-benzyl-1H-indazol-3-yl)oxy)acetate

Guidance literature:

With tert.-butylnitrite; at 40 ℃; for 48h;

Reference yield: 96.0%

ethanol (64-17-5) + bendazac (20187-55-7) → ethyl 2-((1-benzyl-1H-indazol-3-yl)oxy)acetate

Guidance literature:

With tert.-butylnitrite; at 80 ℃; for 48h; Green chemistry;

DOI:10.1002/ejoc.202100326

Downstream raw materials:

Bendacort

1-benzyl-3-methoxy-1H-indazole