4'-Methyl-[1,1'-biphenyl]-4-amine hydrochloride

Base Information

• Chemical Name: 4'-Methyl-[1,1'-biphenyl]-4-amine hydrochloride
• CAS No.: 1204-78-0
• Molecular Formula: C13H13 N
• Molecular Weight: 183.253
• Hs Code.: 2921490090
• European Community (EC) Number: 673-264-3
• Mol file: 1204-78-0.mol

Synonyms:811842-54-3;(4'-methyl-4-biphenylyl)amine hydrochloride;4'-Methyl-[1,1'-biphenyl]-4-amine hydrochloride;4'-methylbiphenyl-4-ylamine hydrochloride;4'-Methyl-biphenyl-4-ylamine hydrochloride;4'-methyl[1,1'-biphenyl]-4-amine;4'-METHYL-BIPHENYL-4-YLAMINE HCl;MFCD04971967;AKOS024396846;FS-6226;SB79429;4-(4-methylphenyl)aniline;hydrochloride;CS-0326358;4'-methyl-[1,1-biphenyl]-4-amine hydrochloride;4'-methyl[1,1'-biphenyl]-4-amine hydrochloride;4'-Methyl-[1,1'-biphenyl]-4-aminehydrochloride

Chemical Property of 4'-Methyl-[1,1'-biphenyl]-4-amine hydrochloride

Chemical Property:

• Melting Point: 99°C
• Refractive Index: 1.6193 (estimate)
• Boiling Point: 321.5 °C at 760 mmHg
• PKA: 4.32±0.10(Predicted)
• Flash Point: 158.2 °C
• PSA: 26.02000
• Density: 1.057 g/cm³
• LogP: 4.62740
• Storage Temp.: 2-8°C
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 219.0814771
• Heavy Atom Count: 15
• Complexity: 162

Purity/Quality:

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

4''-Methyl-[1,1''-biphenyl]-4-amine ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C=C1)C2=CC=C(C=C2)N.Cl

Technology Process of 4'-Methyl-[1,1'-biphenyl]-4-amine hydrochloride

There total 36 articles about 4'-Methyl-[1,1'-biphenyl]-4-amine hydrochloride 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%

4-methylphenylboronic acid (5720-05-8) + 4-bromo-aniline (106-40-1) → 4-(4-methylphenyl)aniline (1204-78-0)

Guidance literature:

With bis(acetonitrile)palladium(II) chloride; potassium phosphate tribasic trihydrate; C₄₀H₃₆AgN₄O₄⁽¹⁺⁾*F₆P^(1-); tetrabutylammonium bromide; In water monomer; at 50 ℃; for 24h; Darkness; Inert atmosphere; Schlenk technique;

DOI:10.1016/j.jorganchem.2013.07.001

Reference yield: 97.0%

3-methyl-1-(4-((4'-nitrobiphenyl-4-yl)methyl)piperazin-1-yl)butan-1-one (1316807-78-9) → 4-(4-methylphenyl)aniline (1204-78-0)

Guidance literature:

With 10% palladium on activated charcoal; hydrogen; In ethanol; ethyl acetate; at 65 ℃;

DOI:10.1016/j.tetlet.2011.05.025

Reference yield: 95.0%

4-nitro-4'-methyl-1,1'-biphenyl (2143-88-6) → 4-(4-methylphenyl)aniline (1204-78-0)

Guidance literature:

With nickel; In ethanol; ethyl acetate; at 65 ℃;

DOI:10.1016/j.tet.2012.08.062

upstream raw materials:

N-Phenylhydroxylamine

nitrobenzene

toluene

4-nitro-4'-methyl-1,1'-biphenyl

Downstream raw materials:

N-(4'-methyl-3-(N-(phenylsulfonyl)phenylsufonamido)biphenyl-4-yl)acetamide

N-(4'-methyl-3-(N-(phenylsulfonyl)phenylsufonamido)biphenyl-4-yl)pivalamide

N-(4'-methyl-3-(N-(phenylsulfonyl)phenylsufonamido)biphenyl-4-yl)benzamide

4-benzoylamino-4'-methyl-1,1'-biphenyl

Refernces

• 1、 Liu, Zhaosheng,Zhong, Shuai,Ji, Xiaochen,Deng, Guo-Jun,Huang, Huawen. "Photoredox Cyclization of N-Arylacrylamides for Synthesis of Dihydroquinolinones". supporting information. p. 349 - 353. Retrieved 2021/12/27.
• 2、 Gao, Ge,Liu, Yan,She, Zhijie,Wang, Tianbao,Zheng, Qinze,Zheng, Xuesong. "Rigid chelating dicarbene ligands based on naphthyridine-fused bisimidazolium salts". supporting information. . Retrieved 2021/11/26.