4-Benzyloxychlorobenzene

Base Information

• Chemical Name: 4-Benzyloxychlorobenzene
• CAS No.: 7700-27-8
• Molecular Formula: C13H11ClO
• Molecular Weight: 218.683
• Hs Code.: 2909309090
• European Community (EC) Number: 673-549-2
• DSSTox Substance ID: DTXSID80227819
• Nikkaji Number: J250J
• Wikidata: Q83107647
• Mol file: 7700-27-8.mol

Synonyms:4-Benzyloxychlorobenzene;7700-27-8;1-(Benzyloxy)-4-chlorobenzene;1-chloro-4-phenylmethoxybenzene;Benzene,1-chloro-4-(phenylmethoxy)-;Benzene, 1-chloro-4-(phenylmethoxy)-;4-chlorophenyl benzyl ether;Benzyl 4-chlorophenyl ether;1-benzyloxy-4-chlorobenzene;1-benzyloxy-4-chloro-benzene;SCHEMBL197223;Chloro-4-(phenylmethoxy)benzene;DTXSID80227819;OBCBJNFGAMHBTC-UHFFFAOYSA-N;1-chloranyl-4-phenylmethoxy-benzene;MFCD00079702;AKOS001582042;1-Chloro-4-[(phenylmethyl)oxy]benzene;CCG-103689;FS-3914;CS-0363681;EU-0034247;FT-0636572;A838940;SR-01000395916;Q-200403;SR-01000395916-1

Chemical Property of 4-Benzyloxychlorobenzene

Chemical Property:

• Vapor Pressure: 0.000574mmHg at 25°C
• Melting Point: 70 °C
• Refractive Index: 1.584
• Boiling Point: 321 °C at 760 mmHg
• Flash Point: 149 °C
• PSA: 9.23000
• Density: 1.175 g/cm³
• LogP: 3.91900
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 4.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 218.0498427
• Heavy Atom Count: 15
• Complexity: 169

Purity/Quality:

98%min ^*data from raw suppliers

4-Benzyloxychlorobenzene ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)COC2=CC=C(C=C2)Cl

Technology Process of 4-Benzyloxychlorobenzene

There total 31 articles about 4-Benzyloxychlorobenzene 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%

benzyl bromide (100-39-0) + 4-chloro-phenol (106-48-9,82344-39-6) → 4-chlorophenyl benzyl ether (7700-27-8)

Guidance literature:

With potassium phosphate; tetrabutylammomium bromide; In water; at 20 ℃; for 2h; Sealed tube; Green chemistry;

DOI:10.1016/j.tet.2014.01.004

Reference yield: 99.0%

(benzyloxy)benzene (946-80-5) → 4-chlorophenyl benzyl ether (7700-27-8)

Guidance literature:

With kaolin; sodium chlorite; manganese(III) acetylacetonate; In dichloromethane; at 25 ℃; for 1h;

DOI:10.1039/a804043e

Reference yield: 96.31%

benzyl chloride (100-44-7) + 4-chloro-phenol (106-48-9,82344-39-6) → 4-chlorophenyl benzyl ether (7700-27-8)

Guidance literature:

4-chloro-phenol; With potassium carbonate; In N,N-dimethyl-formamide; at 80 ℃; for 1h;

benzyl chloride; In N,N-dimethyl-formamide; at 105 ℃; for 1h; Concentration;

upstream raw materials:

(benzyloxy)benzene

benzyl chloride

sodium 4-chlorophenolate

sodium methylate

Downstream raw materials:

2-monochlorophenol

benzyl chloride

4-chloro-phenol

N,N-diphenylbenzylamine

Refernces

• 1、 -. "MALIC ENZYME INHIBITORS". Page/Page column 94. . Retrieved 2021/04/23.
• 2、 Ray, Ritwika,Hartwig, John F.. "Oxalohydrazide Ligands for Copper-Catalyzed C?O Coupling Reactions with High Turnover Numbers". supporting information. p. 8203 - 8211. Retrieved 2021/03/08.