N-Methylsalicylamide

Base Information

• Chemical Name: N-Methylsalicylamide
• CAS No.: 1862-88-0
• Molecular Formula: C8H9 N O2
• Molecular Weight: 151.165
• Hs Code.: 2924299090
• European Community (EC) Number: 833-635-4
• NSC Number: 522443
• UNII: QCE3HZ1G0G
• DSSTox Substance ID: DTXSID80171868
• Nikkaji Number: J48.305B
• Wikidata: Q83042017
• Mol file: 1862-88-0.mol

Synonyms:N-Methylsalicylamide;2-Hydroxy-N-methylbenzamide;1862-88-0;Salicylmethylamide;Salicylamide, N-methyl-;Benzamide, 2-hydroxy-N-methyl-;NSC 522443;QCE3HZ1G0G;N-Methyl-o-hydroxybenzamide;N-Methyl-2-hydroxybenzamide;BRN 1100579;2-Hydroxy-N-methyl-benzamide;MFCD00045757;NSC-522443;3-10-00-00152 (Beilstein Handbook Reference);NSC522443;UNII-QCE3HZ1G0G;WLN: QR BVM1;2-hydroxy-N-methyl benzamide;2-Hydroxy-N-methylbenzamide #;SCHEMBL1799299;N-Methylsalicylamide, AldrichCPR;DTXSID80171868;AMY37323;BCP33934;CS-B1147;Benzoic amide, 2-hydroxy-N-methyl-;AC1616;BBL010949;STK802055;AKOS000207235;HF-0760;MB00422;SY034205;LS-144171;FT-0633882;EN300-38931;J-011953;Z57148963

Chemical Property of N-Methylsalicylamide

Chemical Property:

• Vapor Pressure: 6.02E-05mmHg at 25°C
• Melting Point: 89 °C
• Boiling Point: 335.8°Cat760mmHg
• PKA: 8.48±0.35(Predicted)
• Flash Point: 156.9°C
• PSA: 49.33000
• Density: 1.179g/cm³
• LogP: 1.14270
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 1.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 151.063328530
• Heavy Atom Count: 11
• Complexity: 147

Purity/Quality:

97% ^*data from raw suppliers

2-Hydroxy-N-methylbenzamide ^*data from reagent suppliers

Safty Information:

• Statements: 41
• Safety Statements: 26-39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CNC(=O)C1=CC=CC=C1O

Technology Process of N-Methylsalicylamide

There total 15 articles about N-Methylsalicylamide 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: 88.0%

methyl isocyanate (624-83-9) + phenol (108-95-2,27073-41-2) → N-methylsalicylamide (1862-88-0)

Guidance literature:

With aluminium trichloride; In toluene; at 20 ℃; for 12h;

DOI:10.1039/b316802f

Reference yield: 87.0%

C17H19NO2 → N-methylsalicylamide (1862-88-0)

Guidance literature:

With 2,2,2-trifluoroethanol; for 11h; Heating;

DOI:10.1021/ol990846b

Reference yield: 80.0%

2-hydroxyacetophenoneoxime (1196-29-8) → N-methylsalicylamide (1862-88-0)

Guidance literature:

With indium(III) triflate; In acetonitrile; for 2.5h; Heating;

upstream raw materials:

phenyl Salicylate

methylamine

methyl salicylate

2-(methylcarbamoyl)phenyl acetate

Downstream raw materials:

2-benzoyloxy-benzoic acid methylamide

2-methoxy-N-methylbenzamide

2-α-L-arabinopyranosyloxy-benzoic acid methylamide

2-(tri-O-acetyl-β-D-xylopyranosyloxy)-benzoic acid methylamide