1-Phenoxynaphthalene

Base Information

• Chemical Name: 1-Phenoxynaphthalene
• CAS No.: 3402-76-4
• Molecular Formula: C16H12O
• Molecular Weight: 220.271
• Hs Code.: 2909309090
• NSC Number: 37150
• DSSTox Substance ID: DTXSID40284408
• Nikkaji Number: J80.722B
• Wikidata: Q82019343
• Mol file: 3402-76-4.mol

Synonyms:1-phenoxynaphthalene;3402-76-4;phenoxynaphthalene;NSC37150;1-Naphthyl phenyl ether;Naphthalene, 1-phenoxy-;1-Naphthyl phenyl ether #;SCHEMBL441860;DABOOAVTBIRGHP-UHFFFAOYSA-;DTXSID40284408;NSC-37150;InChI=1/C16H12O/c1-2-9-14(10-3-1)17-16-12-6-8-13-7-4-5-11-15(13)16/h1-12H

Chemical Property of 1-Phenoxynaphthalene

Chemical Property:

• Vapor Pressure: 9.45E-05mmHg at 25°C
• Melting Point: 55.5°C
• Refractive Index: 1.5800 (estimate)
• Boiling Point: 349.5°Cat760mmHg
• Flash Point: 166.8°C
• PSA: 9.23000
• Density: 1.134g/cm³
• LogP: 4.63210
• XLogP3: 5.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 2
• Exact Mass: 220.088815002
• Heavy Atom Count: 17
• Complexity: 232

Purity/Quality:

99%min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)OC2=CC=CC3=CC=CC=C32

Technology Process of 1-Phenoxynaphthalene

There total 22 articles about 1-Phenoxynaphthalene 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: 95.0%

iodobenzene (591-50-4) + α-naphthol (90-15-3) → 1-phenoxynaphthalene (3402-76-4)

Guidance literature:

With potassium carbonate; at 120 ℃; for 5h;

DOI:10.1039/c4ra06486k

Reference yield: 94.0%

bromobenzene (108-86-1,52753-63-6) + α-naphthol (90-15-3) → 1-phenoxynaphthalene (3402-76-4)

Guidance literature:

With copper(l) iodide; iron(III)-acetylacetonate; potassium carbonate; In N,N-dimethyl-formamide; at 135 ℃; for 12h; Inert atmosphere;

DOI:10.1055/s-0030-1259291

Reference yield: 90.0%

1-Iodonaphthalene (90-14-2) + phenol (108-95-2,27073-41-2) → 1-phenoxynaphthalene (3402-76-4)

Guidance literature:

With caesium carbonate; acetylacetone; In N,N-dimethyl-formamide; at 130 ℃; for 4h; Inert atmosphere;

DOI:10.1002/cctc.201801111

upstream raw materials:

bromobenzene

α-naphthol

phenol

1-Bromonaphthalene

Downstream raw materials:

1-naphthalen-1-yl-piperidine

2-phenylnaphthalen-1-ol

α-naphthol

phenol

Refernces

• 1、 Ding, Zhiqiang,Nie, Nan,Chen, Tian,Meng, Lingxin,Wang, Gongshu,Chen, Zhangpei,Hu, Jianshe. "L-Proline N-oxide dihydrazides as an efficient ligand for cross-coupling reactions of aryl iodides and bromides with amines and phenols". supporting information. . Retrieved 2020/12/21.
• 2、 -. "Aromatic ether compound or the sulfhydryl compound". Paragraph 0072; 0074; 0077; 0109. . Retrieved 2021/11/19.