Formamide, N-(2-methylphenyl)-

Base Information

• Chemical Name: Formamide, N-(2-methylphenyl)-
• CAS No.: 94-69-9
• Molecular Formula: C8H9 N O
• Molecular Weight: 135.166
• Hs Code.: 2924299090
• European Community (EC) Number: 202-355-9
• NSC Number: 406128,62002
• DSSTox Substance ID: DTXSID6059108
• Nikkaji Number: J28.438F
• Wikidata: Q81988667
• Mol file: 94-69-9.mol

Synonyms:94-69-9;2'-Methylformanilide;2-Methylformanilide;N-o-Tolylformamide;N-(2-METHYLPHENYL)FORMAMIDE;Formamide, N-(2-methylphenyl)-;o-Formotoluidide;o-Tolylformamide;o-Methylformanilide;o-Methyl-N-formylaniline;N-Formyl-2-methylaniline;2-Methylphenylformamide;NSC 406128;AI3-01417;EINECS 202-355-9;N-(2-Tolyl)formamide;Formyl-o-toluidin;2'-methylformanilid;2-formylaminotoluene;N-o-tolyl-formamide;N-Formyl-o-toluidine;2 -formylaminotoluene;2-formylamino-toluene;2/'-Methylformanilide;NCIOpen2_003729;N-(2-methylphenyl)methanamide;SCHEMBL225741;SCHEMBL9800974;N-(2-Tolyl)formamide, 97%;DTXSID6059108;NSC62002;MFCD00014122;NSC-62002;NSC406128;AKOS004909858;NSC-406128;AS-54916;CS-0038689;FT-0613042;M1431;W11048;A845044;AB-131/41338123

Chemical Property of Formamide, N-(2-methylphenyl)-

Chemical Property:

• Appearance/Colour: slightly beige powder
• Melting Point: 58-62 °C(lit.)
• Refractive Index: 1.5589 (estimate)
• Boiling Point: 287-289°C
• PKA: 15.01±0.70(Predicted)
• Flash Point: 163.8°C
• PSA: 29.10000
• Density: 1.103g/cm³
• LogP: 2.27220
• XLogP3: 0.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 135.068413911
• Heavy Atom Count: 10
• Complexity: 114

Purity/Quality:

98%,99%, ^*data from raw suppliers

2'-Methylformanilide >98.0%(GC) ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn
• Statements: 22-36-42/43
• Safety Statements: 22-26-36/37-45

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC1=CC=CC=C1NC=O

Technology Process of Formamide, N-(2-methylphenyl)-

There total 44 articles about Formamide, N-(2-methylphenyl)- 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: 98.0%

o-toluidine (95-53-4) + formic acid ethyl ester (109-94-4) → 2'-methylformanilide (94-69-9)

Guidance literature:

With N¹-(3-(trimethoxysilyl)propyl)ethane-1,2-diamine-sulfamic acid supported on mesoporous silica SBA-15; In neat (no solvent); at 50 ℃; Green chemistry;

DOI:10.1016/j.molcata.2015.11.002

Reference yield: 98.0%

acetic anhydride (108-24-7) + o-toluidine (95-53-4) → 2'-methylformanilide (94-69-9)

Guidance literature:

With potassium acetate; In benzene; at 80 ℃; for 0.75h;

Reference yield: 96.0%

formic acid (64-18-6) + 1-methyl-2-nitrobenzene (88-72-2) → 2'-methylformanilide (94-69-9)

Guidance literature:

With gold nano particles supported on rutile TiO₂; In toluene; at 70 ℃; for 3.5h; under 750.075 Torr; chemoselective reaction; Inert atmosphere;

DOI:10.1002/cssc.201500869

upstream raw materials:

formic acid

o-tolyl isocyanide

formamide

acetic acid

Downstream raw materials:

4-o-tolyl-1,2,4-triazole

2-methyl-1-(o-tolyl)pyrrolidine

N,N'-bis(2-methylphenyl)formamidine

N,N'-bis(2-methylphenyl)urea

Refernces

• 1、 -. "Method for synthesizing P-chloroO-toluidine". Paragraph 0094-0095. . Retrieved 2021/10/05.
• 2、 Guo, Luxia,Chen, Zihao,Zhu, Hongmei,Li, Minghao,Gu, Yanlong. "Acid-catalyzed chemodivergent reactions of 2,2-dimethoxyacetaldehyde and anilines". supporting information. p. 1419 - 1422. Retrieved 2020/11/12.