(4'-Methyl-[1,1'-biphenyl]-4-yl)methanol

Base Information

• Chemical Name: (4'-Methyl-[1,1'-biphenyl]-4-yl)methanol
• CAS No.: 79757-92-9
• Molecular Formula: C₁₄H₁₄O
• Molecular Weight: 198.265
• Hs Code.: 2906299090
• DSSTox Substance ID: DTXSID90362745
• Nikkaji Number: J1.838.820K
• Wikidata: Q82146115
• Mol file: 79757-92-9.mol

Synonyms:79757-92-9;(4'-Methyl-[1,1'-biphenyl]-4-yl)methanol;[4-(4-methylphenyl)phenyl]methanol;(4'-METHYLBIPHENYL-4-YL)-METHANOL;4-(4-Methylphenyl)benzyl alcohol;(4'-Methyl[1,1'-biphenyl]-4-yl)methanol;(4'-methylbiphenyl-4-yl)methanol;{4'-methyl-[1,1'-biphenyl]-4-yl}methanol;[4'-Methyl-(1,1'-biphenyl)-4-yl]methanol;4'-Methylbiphenyl-4-methanol;SCHEMBL258820;DTXSID90362745;CS-D0387;(4'-Methyl-biphenyl-4-yl)methanol;MFCD01862514;AKOS002683257;AS-3153;[4'Methyl-(1,1-biphenyl)-4-yl]methanol;BB 0223513

Chemical Property of (4'-Methyl-[1,1'-biphenyl]-4-yl)methanol

Chemical Property:

• Melting Point: 119 °C
• Boiling Point: 351.1±21.0 °C(Predicted)
• PKA: 14.37±0.10(Predicted)
• PSA: 20.23000
• Density: 1.072±0.06 g/cm3(Predicted)
• LogP: 3.15430
• XLogP3: 3.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 198.104465066
• Heavy Atom Count: 15
• Complexity: 174

Purity/Quality:

99% ^*data from raw suppliers

(4''-Methylbiphenyl-4-yl)-methanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of (4'-Methyl-[1,1'-biphenyl]-4-yl)methanol

There total 16 articles about (4'-Methyl-[1,1'-biphenyl]-4-yl)methanol 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: 100.0%

4-(4-methylphenyl)benzaldehyde (36393-42-7) → (4'-methyl-[1,1'-biphenyl]-4-yl)methanol (79757-92-9)

Guidance literature:

With sodium tetrahydroborate; In ethanol; at 0 - 20 ℃; for 0.5h; Inert atmosphere;

DOI:10.1021/acs.jmedchem.0c01372

Reference yield: 99.0%

para-bromotoluene (106-38-7) + p-hydroxymethylphenylboronic acid (59016-93-2) → (4'-methyl-[1,1'-biphenyl]-4-yl)methanol (79757-92-9)

Guidance literature:

With 5%-palladium/activated carbon; ammonium bicarbonate; In water; at 100 ℃; for 24h; Time; Inert atmosphere; Schlenk technique;

DOI:10.1002/ejoc.201501169

Reference yield: 99.0%

4-bromobenzenemethanol (873-75-6) + 4-methylphenylboronic acid (5720-05-8) → (4'-methyl-[1,1'-biphenyl]-4-yl)methanol (79757-92-9)

Guidance literature:

With 5%-palladium/activated carbon; ammonium bicarbonate; In water; at 100 ℃; for 24h; Time; Inert atmosphere; Schlenk technique;

DOI:10.1002/ejoc.201501169

upstream raw materials:

4-methylphenylboronic acid

para-bromotoluene

p-hydroxymethylphenylboronic acid

4-carboxyphenylboronic acid

Downstream raw materials:

(4'-methyl[biphenyl]-4-yl)benzo[d]oxazole