4-Benzyl-2,6-dichlorophenol

Base Information

• Chemical Name: 4-Benzyl-2,6-dichlorophenol
• CAS No.: 38932-58-0
• Molecular Formula: C13H10 Cl2 O
• Molecular Weight: 253.128
• Hs Code.: 2908199090
• European Community (EC) Number: 254-194-9
• DSSTox Substance ID: DTXSID10192223
• Nikkaji Number: J319.866I
• Wikidata: Q83064877
• Mol file: 38932-58-0.mol

Synonyms:4-Benzyl-2,6-dichlorophenol;38932-58-0;EINECS 254-194-9;4-Benzyl-2,6-dichloro-phenol;DTXSID10192223;AKOS000114427;Phenol, 2,6-dichloro-4-(phenylmethyl)-;BB 0246749

Chemical Property of 4-Benzyl-2,6-dichlorophenol

Chemical Property:

• Vapor Pressure: 4.1E-05mmHg at 25°C
• Boiling Point: 341.4°Cat760mmHg
• Flash Point: 134.3°C
• PSA: 20.23000
• Density: 1.324g/cm³
• LogP: 4.28980
• XLogP3: 4.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 252.0108703
• Heavy Atom Count: 16
• Complexity: 204

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C=C1)CC2=CC(=C(C(=C2)Cl)O)Cl

Technology Process of 4-Benzyl-2,6-dichlorophenol

There total 7 articles about 4-Benzyl-2,6-dichlorophenol 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: 60.7%

p-benzylphenol (101-53-1) → 4-benzyl-2,6-dichloro-phenol (38932-58-0)

Guidance literature:

With sodium hypochlorite; sodium chloride; sodium hydroxide; In methanol; at 5 - 15 ℃; for 13h;

Reference yield:

4-benzyl-2-chlorophenol (31089-49-3) → 4-benzyl-2,6-dichloro-phenol (38932-58-0)

Guidance literature:

With chloroform; chlorine;

DOI:10.1021/ja01338a052

Reference yield:

2-monochlorophenol (95-57-8) → 4-benzyl-2,6-dichloro-phenol (38932-58-0)

Guidance literature:

Multi-step reaction with 2 steps

1: AlCl₃; petroleum ether / 20 - 35 °C

2: chloroform; chlorine

With aluminium trichloride; chloroform; chlorine; Petroleum ether;

DOI:10.1021/ja01338a052

upstream raw materials:

p-benzylphenol

4-benzyl-2-chlorophenol

2,6-Dichlorophenol

benzyl alcohol

Downstream raw materials:

(3,5-dichloro-4-hydroxyphenyl)(phenyl)methanone

Refernces