2-(1H-Tetrazol-1-YL)benzamide

Base Information

• Chemical Name: 2-(1H-Tetrazol-1-YL)benzamide
• CAS No.: 449758-24-1
• Molecular Formula: C8H7 N5 O
• Molecular Weight: 189.176
• DSSTox Substance ID: DTXSID10357638
• Wikidata: Q82137634
• Mol file: 449758-24-1.mol

Synonyms:2-(1H-TETRAZOL-1-YL)BENZAMIDE;449758-24-1;2-(1-Tetrazolyl)benzamide;2-(tetrazol-1-yl)benzamide;2-Tetrazol-1-yl-benzamide;2-(1H-1,2,3,4-TETRAZOL-1-YL)BENZAMIDE;SCHEMBL3328193;DTXSID10357638;PFZBNUJWWHCHJX-UHFFFAOYSA-N;2-(1H-tetrazol-1-yl)-benzamide;AC6159;MFCD02585734;AKOS006241463;AB11893;SY040072;BENZAMIDE,2-(1H-TETRAZOL-1-YL)-;FT-0695475

Chemical Property of 2-(1H-Tetrazol-1-YL)benzamide

Chemical Property:

• PSA: 86.69000
• LogP: 0.46150
• XLogP3: 0.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 189.06505986
• Heavy Atom Count: 14
• Complexity: 222

Purity/Quality:

97% ^*data from raw suppliers

2-(1H-Tetrazol-1-yl)benzamide 97% ^*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)N)N2C=NN=N2

Technology Process of 2-(1H-Tetrazol-1-YL)benzamide

There total 2 articles about 2-(1H-Tetrazol-1-YL)benzamide 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: 72.0%

2-Tetrazol-1-yl-benzoic acid (116570-12-8) → 2-Tetrazol-1-yl-benzamide (449758-24-1)

Guidance literature:

2-Tetrazol-1-yl-benzoic acid; With thionyl chloride; at 90 ℃; for 4h;

With ammonium hydroxide; In dichloromethane; at 5 ℃;

DOI:10.1016/j.bmc.2019.02.029

Reference yield:

anthranilic acid (118-92-3,159201-01-1,50816-84-7,80206-34-4,104809-47-4) → 2-Tetrazol-1-yl-benzamide (449758-24-1)

Guidance literature:

Multi-step reaction with 2 steps

1: NaN₃; glacial AcOH / 2 h / 20 °C

2: NH₄Cl; EDC; HOAt / iPr₂NEt / dimethylformamide / 20 °C

With sodium azide; 1-hydroxy-7-aza-benzotriazole; ammonium chloride; acetic acid; N-(3-dimethylaminopropyl)-N-ethylcarbodiimide; N-ethyl-N,N-diisopropylamine; In N,N-dimethyl-formamide;

DOI:10.1021/jm030303e

Reference yield: 67.0%

2-Tetrazol-1-yl-benzamide (449758-24-1) → 2-(1H-tetrazol-1-yl)benzothioamide

Guidance literature:

With Lawessons reagent; In tetrahydrofuran; at 65 ℃; for 2h; Inert atmosphere;

DOI:10.1016/j.bmc.2019.02.029

upstream raw materials:

2-Tetrazol-1-yl-benzoic acid

anthranilic acid

Downstream raw materials:

2-Tetrazol-1-yl-benzonitrile

2-Tetrazol-1-yl-benzylamine

{(R)-1-Benzyl-2-oxo-2-[(S)-2-(2-tetrazol-1-yl-benzylcarbamoyl)-pyrrolidin-1-yl]-ethyl}-carbamic acid tert-butyl ester

Post a RFQ

Cas No.:

Product Name:

Quantity:

Please select Metric Ton KG G Pound L ML

Email:

Company name:

Valid Period:

Detailed Requirements:

• Sample
• MOQ
• GMP
• FDA
• Price
  FOB CIF CFR EXW
• Urgent purchase

Enter 15 to 2000 letters.Word count: 0 letters

Attach files(File Format: Jpeg, Jpg, Gif, Png, PDF, PPT, Zip, Rar,Word or Excel Maximum File Size: 3MB)

Remove

Submit

1

What can I do for you?
Get Best Price

Get Best Price for 449758-24-1 2-(1H-TETRAZOL-1-YL)BENZAMIDE

Send

Send

Metric Ton KG G Pound L ML

Send

Send