(4-Methylnaphthalen-1-yl)methanamine

Base Information

• Chemical Name: (4-Methylnaphthalen-1-yl)methanamine
• CAS No.: 771580-36-0
• Molecular Formula: C₁₂H₁₃N
• Molecular Weight: 171.242
• Hs Code.: 2921499090
• DSSTox Substance ID: DTXSID60695375
• Wikidata: Q82624539
• Mol file: 771580-36-0.mol

Synonyms:771580-36-0;(4-methylnaphthalen-1-yl)methanamine;4-METHYLNAPHTHALEN-1-YLMETHYLAMINE;1-Naphthalenemethanamine,4-methyl-;1-(4-Methylnaphthalen-1-yl)methanamine;SCHEMBL3914647;DTXSID60695375;AKOS006293799;EN300-253126

Chemical Property of (4-Methylnaphthalen-1-yl)methanamine

Chemical Property:

• PSA: 26.02000
• LogP: 3.30720
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 171.104799419
• Heavy Atom Count: 13
• Complexity: 167

Purity/Quality:

98% ^*data from raw suppliers

(4-methylnaphthalen-1-yl)methanamine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC=C(C2=CC=CC=C12)CN

Technology Process of (4-Methylnaphthalen-1-yl)methanamine

There total 5 articles about (4-Methylnaphthalen-1-yl)methanamine 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:

1-cyano-4-methylnaphthalene (36062-93-8) → C-(4-methyl-[1]naphthyl)-methylamine (771580-36-0)

Guidance literature:

With lithium aluminium tetrahydride; In tetrahydrofuran; at 0 ℃; for 24h; Reflux;

DOI:10.2174/1573406412666160915163002

Reference yield:

1-bromo-4-methylnaphthalene (6627-78-7) → C-(4-methyl-[1]naphthyl)-methylamine (771580-36-0)

Guidance literature:

Multi-step reaction with 3 steps

1: magnesium; diethyl ether / anschliessende Umsetzung mit Dimethylsulfat

2: aqueous HNO₃ / unter Kuehlung

3: platinum; ethanol / Hydrogenation

With diethyl ether; ethanol; nitric acid; magnesium; platinum;

DOI:10.1039/jr9320002015

Reference yield:

1-Methylnaphthalene (90-12-0,34475-76-8) → C-(4-methyl-[1]naphthyl)-methylamine (771580-36-0)

Guidance literature:

Multi-step reaction with 3 steps

1: N-Bromosuccinimide / acetonitrile / 24 h / 30 - 40 °C

2: N,N-dimethyl-formamide / 12 h / 130 °C / Inert atmosphere

3: lithium aluminium tetrahydride / tetrahydrofuran / 24 h / 0 °C / Reflux

With N-Bromosuccinimide; lithium aluminium tetrahydride; In tetrahydrofuran; N,N-dimethyl-formamide; acetonitrile;

DOI:10.2174/1573406412666160915163002

upstream raw materials:

4-methyl-1-(nitromethyl)naphthalene

1-bromo-4-methylnaphthalene

1,4-dimethylnaphthalene

1-cyano-4-methylnaphthalene