2-Fluoro-6-methylnaphthalene

Base Information

• Chemical Name: 2-Fluoro-6-methylnaphthalene
• CAS No.: 324-42-5
• Molecular Formula: C₁₁H₉F
• Molecular Weight: 160.191
• Hs Code.: 2903999090
• DSSTox Substance ID: DTXSID10369473
• Nikkaji Number: J1.559.517E
• Wikidata: Q82156571
• Mol file: 324-42-5.mol

Synonyms:2-fluoro-6-methylnaphthalene;324-42-5;6-fluoro-2-methylnaphthalene;Maybridge1_006492;2-Methyl-6-fluoronaphthalene;SCHEMBL806323;HMS559P02;DTXSID10369473;IKKGPHTUCGWMPE-UHFFFAOYSA-N;CCG-40732;MFCD00831714;AKOS006230181;FT-0612396;SR-01000630856-1

Chemical Property of 2-Fluoro-6-methylnaphthalene

Chemical Property:

• Vapor Pressure: 0.0403mmHg at 25°C
• Melting Point: 73 °C
• Refractive Index: 1.594
• Boiling Point: 247.5°Cat760mmHg
• Flash Point: 84.5°C
• PSA: 0.00000
• Density: 1.112g/cm³
• LogP: 3.28730
• Storage Temp.: 2-8°C
• XLogP3: 3.6
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 160.068828449
• Heavy Atom Count: 12
• Complexity: 155

Purity/Quality:

98%min ^*data from raw suppliers

2-fluoro-6-methylnaphthalene ^*data from reagent suppliers

Safty Information:

• Pictogram(s): R36/37/38:Irritating to eyes, respiratory system and skin.
• Hazard Codes: Xi:Irritant
• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC2=C(C=C1)C=C(C=C2)F

Technology Process of 2-Fluoro-6-methylnaphthalene

There total 7 articles about 2-Fluoro-6-methylnaphthalene 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:

6-fluoro-2-tetralone (29419-14-5) → 2-fluoro-6-methylnaphthalene (324-42-5)

Guidance literature:

Multi-step reaction with 2 steps

1: TiCl₄ / CH₂Cl₂; tetrahydrofuran / 2 h / 0 °C

2: Ph₃COH, TFA / 48 h / Ambient temperature

With triphenylmethyl alcohol; titanium tetrachloride; trifluoroacetic acid; In tetrahydrofuran; dichloromethane;

DOI:10.1021/jm00069a006

Reference yield:

p-Fluorophenylacetic acid (405-50-5) → 2-fluoro-6-methylnaphthalene (324-42-5)

Guidance literature:

Multi-step reaction with 4 steps

1: SOCl₂, DMF / CH₂Cl₂ / 18 h

2: AlCl₃ / CH₂Cl₂ / 0.25 h / -10 °C

3: TiCl₄ / CH₂Cl₂; tetrahydrofuran / 2 h / 0 °C

4: Ph₃COH, TFA / 48 h / Ambient temperature

With aluminium trichloride; thionyl chloride; triphenylmethyl alcohol; titanium tetrachloride; N,N-dimethyl-formamide; trifluoroacetic acid; In tetrahydrofuran; dichloromethane;

DOI:10.1021/jm00069a006

Reference yield:

4-Fluorophenylacetyl chloride (459-04-1) → 2-fluoro-6-methylnaphthalene (324-42-5)

Guidance literature:

Multi-step reaction with 3 steps

1: AlCl₃ / CH₂Cl₂ / 0.25 h / -10 °C

2: TiCl₄ / CH₂Cl₂; tetrahydrofuran / 2 h / 0 °C

3: Ph₃COH, TFA / 48 h / Ambient temperature

With aluminium trichloride; triphenylmethyl alcohol; titanium tetrachloride; trifluoroacetic acid; In tetrahydrofuran; dichloromethane;

DOI:10.1021/jm00069a006

upstream raw materials:

6-fluoro-2-tetralone

p-Fluorophenylacetic acid

4-Fluorophenylacetyl chloride

Downstream raw materials:

2-bromomethyl-6-fluoronaphthalene

(6-fluoro-naphthalene-2-yl)-acetonitrile

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