2-Naphthyl formate

Base Information

• Chemical Name: 2-Naphthyl formate
• CAS No.: 1988-18-7
• Molecular Formula: C11H8O2
• Molecular Weight: 172.183
• Hs Code.: 2915120000
• European Community (EC) Number: 217-863-6
• DSSTox Substance ID: DTXSID30173635
• Nikkaji Number: J199.804H
• Wikidata: Q83043678
• Mol file: 1988-18-7.mol

Synonyms:2-Naphthyl formate;naphthalen-2-yl formate;1988-18-7;EINECS 217-863-6;SCHEMBL97419;Formic acid 2-naphthyl ester;DTXSID30173635

Chemical Property of 2-Naphthyl formate

Chemical Property:

• Vapor Pressure: 0.00346mmHg at 25°C
• Boiling Point: 291.1°C at 760 mmHg
• Flash Point: 117.8°C
• PSA: 26.30000
• Density: 1.188g/cm³
• LogP: 3.01090
• XLogP3: 3.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 172.052429494
• Heavy Atom Count: 13
• Complexity: 179

Purity/Quality:

98%Min ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C=C(C=CC2=C1)OC=O

Technology Process of 2-Naphthyl formate

There total 8 articles about 2-Naphthyl formate 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%

β-naphthaldehyde (66-99-9) → naphthalen-2-yl formate (1988-18-7)

Guidance literature:

With 3-chloro-benzenecarboperoxoic acid; scandium tris(trifluoromethanesulfonate); In dichloromethane; at 0 ℃; for 0.0833333h;

Reference yield: 95.0%

formic acid (64-18-6) + β-naphthol (135-19-3) → naphthalen-2-yl formate (1988-18-7)

Guidance literature:

formic acid; With acetic anhydride; at 60 ℃; for 1h; Inert atmosphere;

β-naphthol; With sodium hydrogencarbonate; at 20 ℃; for 3.5h; Inert atmosphere;

DOI:10.1021/acs.orglett.6b03233

Reference yield: 88.0%

triformylamine (25891-31-0) + β-naphthol (135-19-3) → naphthalen-2-yl formate (1988-18-7)

Guidance literature:

With sodium diformamide; at 85 ℃; for 2h;

DOI:10.1515/znb-2001-1112

upstream raw materials:

β-naphthaldehyde

N-formylbenzotriazole

β-naphthol

triformylamine

Downstream raw materials:

2-hydroxynaphthalene-1-carbaldehyde

14-(2-hydroxynaphthyl)-14H-dibenzo[a,j]xanthene

β-naphthol

Refernces

• 1、 -. "Oxidizing agent". Paragraph 0104; 0105. . Retrieved 2018/06/19.
• 2、 Jiang, Li-Bing,Li, Rui,Li, Hao-Peng,Qi, Xinxin,Wu, Xiao-Feng. "Palladium-Catalyzed Carbonylative Synthesis of Aryl Formates under Mild Conditions". . p. 1788 - 1791. Retrieved 2016/06/01.