2-Methoxy-1-nitronaphthalene

Base Information

• Chemical Name: 2-Methoxy-1-nitronaphthalene
• CAS No.: 4900-66-7
• Molecular Formula: C11H9NO3
• Molecular Weight: 203.197
• Hs Code.: 2909309090
• European Community (EC) Number: 225-529-6
• NSC Number: 17570
• DSSTox Substance ID: DTXSID80197664
• Nikkaji Number: J262.522I
• Wikidata: Q83070462
• Mol file: 4900-66-7.mol

Synonyms:2-Methoxy-1-nitronaphthalene;4900-66-7;1-nitro-2-methoxynaphthalene;EINECS 225-529-6;Naphthalene, 2-methoxy-1-nitro-;NSC17570;methoxynitronaphthalene;SCHEMBL4594864;2-Methoxy-1-nitronaphthalene #;DTXSID80197664;MFCD00100119;NSC 17570;NSC-17570;AKOS021984609;PS-4446;CS-0323072;F71556

Chemical Property of 2-Methoxy-1-nitronaphthalene

Chemical Property:

• Vapor Pressure: 5.53E-05mmHg at 25°C
• Boiling Point: 357.7°Cat760mmHg
• Flash Point: 172.1°C
• PSA: 55.05000
• Density: 1.274g/cm³
• LogP: 3.27980
• XLogP3: 3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 203.058243149
• Heavy Atom Count: 15
• Complexity: 239

Purity/Quality:

99% ^*data from raw suppliers

2-Methoxy-1-nitronaphthalene ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: COC1=C(C2=CC=CC=C2C=C1)[N+](=O)[O-]

Technology Process of 2-Methoxy-1-nitronaphthalene

There total 21 articles about 2-Methoxy-1-nitronaphthalene 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: 87.0%

1-nitro-2-naphthol (550-60-7) + methyl iodide (74-88-4) → 2-methoxy-1-nitronaphthalene (4900-66-7)

Guidance literature:

With potassium hydroxide; In acetone; Reflux;

DOI:10.1371/journal.pone.0183575

Reference yield: 75.0%

2-Methoxynaphthalene (93-04-9) → 2-methoxy-1-nitronaphthalene (4900-66-7)

Guidance literature:

With sodium nitrate; benzyltriphenylphosphonium peroxodisulfate; In acetonitrile; for 6h; Heating;

DOI:10.1080/00397910701481179

Reference yield: 63.4%

dimethyl sulfate (77-78-1) + 2-hydroxynitrobenzene (88-75-5,78813-12-4) → 2-methoxy-1-nitronaphthalene (4900-66-7)

Guidance literature:

With potassium carbonate; In acetonitrile; for 1h; Reflux;

DOI:10.1124/mol.113.087502

upstream raw materials:

2-Methoxynaphthalene

2-fluoronaphthalene

acetic acid

methanol

Downstream raw materials:

3-methoxy-1-methylnaphthalene

1-Nitro-2-methoxy-4-(2-phenylethyl)-3,4-dihydronaphthalen

5-nitro-6-methoxy-2-bromonaphthalene

2-methoxynaphthylamine

Refernces

• 1、 -. "PYRIDONE-PYRIMIDINE DERIVATIVE ACTING AS KRASG12C MUTEIN INHIBITOR". Paragraph 0278. . Retrieved 2020/12/07.
• 2、 -. "Method for catalyzing selective nitrification of 2-methoxynaphthalene by utilizing zeolite molecular sieve". Paragraph 0038-0088. . Retrieved 2019/12/29.