2-NAPHTHYL ISOCYANIDE 97

Base Information

• Chemical Name: 2-NAPHTHYL ISOCYANIDE 97
• CAS No.: 10124-78-4
• Molecular Formula: C11H7 N
• Molecular Weight: 153.183
• Hs Code.: 2926909090
• European Community (EC) Number: 623-740-1
• ChEMBL ID: CHEMBL310309
• DSSTox Substance ID: DTXSID30584409
• Nikkaji Number: J908.252B
• Wikidata: Q72485281
• Mol file: 10124-78-4.mol

Synonyms:2-Naphthylisocyanide (6CI,7CI); 2-Isocyanonaphthalene

Chemical Property of 2-NAPHTHYL ISOCYANIDE 97

Chemical Property:

• Melting Point: 60-64 °C(lit.)
• PSA: 0.00000
• LogP: 2.62130
• Storage Temp.: ?20°C
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 153.057849228
• Heavy Atom Count: 12
• Complexity: 200

Purity/Quality:

98%,99%, ^*data from raw suppliers

2-Naphthyl isocyanide 95% ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xn
• Statements: 20/21/22-36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: [C-]#[N+]C1=CC2=CC=CC=C2C=C1

Technology Process of 2-NAPHTHYL ISOCYANIDE 97

There total 5 articles about 2-NAPHTHYL ISOCYANIDE 97 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: 86.0%

2-formamidonaphthalene (4423-74-9) → 2-napthylisocyanide (10124-78-4)

Guidance literature:

With triethylamine; trichlorophosphate; In tetrahydrofuran; at 0 - 25 ℃; Inert atmosphere;

DOI:10.1002/anie.201803300

Reference yield: 55.0%

naphthalen-2-ylamine (91-59-8) + (2-bromo-2,2-difluoro-acetyl)oxysodium → 2-napthylisocyanide (10124-78-4)

Guidance literature:

With potassium phosphate; copper(l) iodide; In acetonitrile; at 100 ℃; for 12h; Schlenk technique;

DOI:10.1039/c8cc09190k

Reference yield: 45.0%

chloroform (67-66-3,8013-54-5) + naphthalen-2-ylamine (91-59-8) → 2-napthylisocyanide (10124-78-4)

Guidance literature:

With sodium hydroxide; tetrabutylammomium bromide; In dichloromethane; at 20 ℃; for 6h;

DOI:10.1021/ja0607990

upstream raw materials:

chloroform

naphthalen-2-ylamine

2-formamidonaphthalene

2-methylquinoline

Downstream raw materials:

2-(2-acetylphenylamino)-N-(naphthalen-2-yl)-2-(4-nitrophenyl)acetamide

2-(2-acetylphenylamino)-2-(4-methoxyphenyl)-N-(naphthalen-2-yl)acetamide

C₁₉H₁₂N₂O₂

C₄₀H₅₀N₄O₉