3-methyl-N-phenylbenzamide

Base Information

• Chemical Name: 3-methyl-N-phenylbenzamide
• CAS No.: 23099-05-0
• Molecular Formula: C14H13 N O
• Molecular Weight: 211.263
• Hs Code.: 2924299090
• DSSTox Substance ID: DTXSID10945776
• Nikkaji Number: J271.289J
• Wikidata: Q82923214
• Mol file: 23099-05-0.mol

Synonyms:3-methyl-N-phenylbenzamide;3-Methylbenzanilide;23099-05-0;m-Toluanilide;Benzamide, 3-methyl-N-phenyl-;N-phenyl-m-toluamide;CBMicro_016723;Cambridge id 5306948;SCHEMBL259666;DTXSID10945776;CCG-5652;MFCD00017211;AKOS000277897;AM803561;BIM-0016660.P001;FT-0757922;3-Methyl-N-phenylbenzene-1-carboximidic acid;AB00079771-01

Chemical Property of 3-methyl-N-phenylbenzamide

Chemical Property:

• PSA: 29.10000
• LogP: 3.32030
• XLogP3: 3
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 211.099714038
• Heavy Atom Count: 16
• Complexity: 233

Purity/Quality:

99%min ^*data from raw suppliers

3-Methylbenzanilide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=CC=C1)C(=O)NC2=CC=CC=C2

Technology Process of 3-methyl-N-phenylbenzamide

There total 55 articles about 3-methyl-N-phenylbenzamide 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: 99.0%

C22H22N2O3 + aniline (62-53-3) → 3-methyl-N-phenylbenzamide (23099-05-0)

Guidance literature:

With [(1,2,3-N)-3-phenyl-2-propenyl][1,3-bis(2,6-diisopropylbenzene)-4,5-dihydroimidazol-2-yl]palladium chloride; potassium carbonate; In tetrahydrofuran; at 110 ℃; for 24h; Schlenk technique; Inert atmosphere;

Reference yield: 96.0%

iodobenzene (591-50-4) + m-toluamide (618-47-3) → 3-methyl-N-phenylbenzamide (23099-05-0)

Guidance literature:

With iron(III) chloride; potassium carbonate; N,N`-dimethylethylenediamine; In toluene; at 135 ℃; for 24h; Inert atmosphere;

DOI:10.1002/chem.200800293

Reference yield: 92.0%

ethyl 3-methylbenzoate (120-33-2) + aniline (62-53-3) → 3-methyl-N-phenylbenzamide (23099-05-0)

Guidance literature:

With chromium chloride; magnesium; In tetrahydrofuran; at 80 ℃; for 12h; Inert atmosphere;

DOI:10.1246/BCSJ.20200277

upstream raw materials:

3-methyl-benzophenone-seqcis-oxime

2-amino-3-methyl-benzoic acid-(N-methyl-anilide); hydrochloride

aniline

3-Methylbenzoyl chloride

Downstream raw materials:

3-methyl-N-phenylbenzothioamide

2-(m-tolyl)benzo[d]thiazole

3-methylbenzyl alcohol

aniline

Refernces

• 1、 Qu, Erdong,Li, Shangzhang,Bai, Jin,Zheng, Yan,Li, Wanfang. "Nickel-Catalyzed Reductive Cross-Coupling of N-Acyl and N-Sulfonyl Benzotriazoles with Diverse Nitro Compounds: Rapid Access to Amides and Sulfonamides". supporting information. p. 58 - 63. Retrieved 2021/12/27.
• 2、 Bai, Jin,Yan, Sijia,Zhang, Zhuxia,Guo, Zhen,Zhou, Cong-Ying. "Visible-Light Carbon Nitride-Catalyzed Aerobic Cyclization of Thiobenzanilides under Ambient Air Conditions". supporting information. p. 4843 - 4848. Retrieved 2021/06/28.