4-(2-Methylanilino)phenol

Base Information

• Chemical Name: 4-(2-Methylanilino)phenol
• CAS No.: 23197-53-7
• Molecular Formula: C13H13 N O
• Molecular Weight: 199.252
• Hs Code.: 2922299090
• European Community (EC) Number: 690-528-3
• DSSTox Substance ID: DTXSID10538561
• Nikkaji Number: J29.872G
• Wikidata: Q72485211
• Mol file: 23197-53-7.mol

Synonyms:23197-53-7;4-(2-Methylanilino)phenol;4-Hydroxy-2'-methyldiphenylamine;4-Hydroxy-2'-methyl diphenylamine;SCHEMBL11019437;DTXSID10538561;YFEJFIBZPXJRSI-UHFFFAOYSA-N;4-[(2-Methylphenyl)amino]-phenol;AKOS006280005;AC-11537

Chemical Property of 4-(2-Methylanilino)phenol

Chemical Property:

• Vapor Pressure: 6.43E-05mmHg at 25°C
• Boiling Point: 334.8°C at 760 mmHg
• Flash Point: 131.6°C
• PSA: 32.26000
• Density: 1.17g/cm³
• LogP: 3.51720
• XLogP3: 3.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 199.099714038
• Heavy Atom Count: 15
• Complexity: 187

Purity/Quality:

99% ^*data from raw suppliers

4-HYDROXY-2'-METHYL DIPHENYLAMINE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=CC=C1NC2=CC=C(C=C2)O

Technology Process of 4-(2-Methylanilino)phenol

There total 6 articles about 4-(2-Methylanilino)phenol 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: 92.0%

2-methylchlorobenzene (95-49-8) + 4-amino-phenol (123-30-8) → 4-[(2-methylphenyl)amino]-phenol (23197-53-7)

Guidance literature:

With chloro[2-(dicyclohexylphosphino)-3,6-dimethoxy-2',4',6'-triisopropyl-1,1'-biphenyl][2-(2-aminoethyl)phenyl]palladium(ll); potassium carbonate; In tert-butyl alcohol; at 110 ℃; for 24h; Inert atmosphere;

DOI:10.1021/ja9081815

Reference yield: 90.0%

2-methylphenyl bromide (95-46-5) + 4-amino-phenol (123-30-8) → 4-[(2-methylphenyl)amino]-phenol (23197-53-7)

Guidance literature:

With chloro[2-(dicyclohexylphosphino)-3,6-dimethoxy-2',4',6'-triisopropyl-1,1'-biphenyl][2-(2-aminoethyl)phenyl]palladium(ll); potassium carbonate; In tert-butyl alcohol; at 110 ℃; for 24h; chemoselective reaction; Inert atmosphere;

DOI:10.1021/ja9081815

Reference yield: 82.0%

hydroquinone (123-31-9,8027-02-9) + o-toluidine (95-53-4) → 4-[(2-methylphenyl)amino]-phenol (23197-53-7)

Guidance literature:

With alumina; at 270 ℃; for 3h; under 4500.45 Torr; Autoclave; Inert atmosphere;

upstream raw materials:

hydroquinone

o-toluidine

2-methylchlorobenzene

4-amino-phenol

Downstream raw materials:

acridine

acridine

(4-ethoxy-phenyl)-o-tolyl-amine

hydroquinone