2-Methylselenobenzanilide

Base Information

• Chemical Name: 2-Methylselenobenzanilide
• CAS No.: 60940-24-1
• Molecular Formula: C14H13 N O Se
• Molecular Weight: 290.223
• Hs Code.: 2924299090
• DSSTox Substance ID: DTXSID90209767
• Nikkaji Number: J487.843D
• Wikidata: Q83084186
• ChEMBL ID: CHEMBL220461
• Mol file: 60940-24-1.mol

Synonyms:2-(methylseleno)benzanilide;2-methylselenobenzanilide;2-MSBAD

Chemical Property of 2-Methylselenobenzanilide

Chemical Property:

• Vapor Pressure: 0.00012mmHg at 25°C
• Boiling Point: 335.4°C at 760 mmHg
• Flash Point: 156.7°C
• PSA: 32.59000
• LogP: 2.70050
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 291.01624
• Heavy Atom Count: 17
• Complexity: 251

Purity/Quality:

2-METHYLSELENOBENZANILIDE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C[Se]C1=CC=CC=C1C(=O)NC2=CC=CC=C2

Technology Process of 2-Methylselenobenzanilide

There total 7 articles about 2-Methylselenobenzanilide 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: 81.8%

2-methylselenobenzoyl chloride (1442-04-2) + aniline (62-53-3) → 2-methylseleno-N-phenylbenzamide (60940-24-1)

Guidance literature:

With triethylamine; In dichloromethane; 0 deg C, room temperature;

Reference yield: 49.0%

N-phenyl benzoyl amide (93-98-1,5705-51-1) + methyl iodide (74-88-4) → 2-methylseleno-N-phenylbenzamide (60940-24-1)

Guidance literature:

N-phenyl benzoyl amide; With n-butyllithium; In tetrahydrofuran; hexane; for 0.5h;

With selenium; In tetrahydrofuran; hexane; for 0.5h;

methyl iodide; In tetrahydrofuran; hexane; at 0 - 20 ℃; for 1.5h;

DOI:10.1016/j.bmcl.2006.07.085

Reference yield: 34.0%

di-tert-butyl peroxide (110-05-4) + 2,2‘-diselenobis(N-phenylbenzamide) (106663-84-7) → 2-phenyl-1,2-benzoisoselenazol-3(2H)-one (60940-34-3) + 2-methylseleno-N-phenylbenzamide (60940-24-1)

Guidance literature:

In chlorobenzene; at 120 ℃;

DOI:10.1016/0040-4039(95)01511-F

upstream raw materials:

2-phenyl-1,2-benzoisoselenazol-3(2H)-one

2-methylselenobenzoyl chloride

aniline

N-phenyl benzoyl amide

Downstream raw materials:

3-chloro-2-phenyl-benzo[d]isoselenazolium; chloride

benzo[d]isoselenazol-3-yl-phenyl-amine

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