2-Naphthalen-1-ylpropan-2-ol

Base Information

• Chemical Name: 2-Naphthalen-1-ylpropan-2-ol
• CAS No.: 6301-54-8
• Molecular Formula: C13H14 O
• Molecular Weight: 186.254
• European Community (EC) Number: 654-403-7
• NSC Number: 42476
• DSSTox Substance ID: DTXSID40285612
• Nikkaji Number: J308.072B
• Wikidata: Q82021051
• Mol file: 6301-54-8.mol

Synonyms:6301-54-8;2-Naphthalen-1-ylpropan-2-ol;2-(Naphthalen-1-yl)propan-2-ol;2-(1-Naphthyl)-2-propanol;NSC42476;dimethyl-a-naphthylcarbinol;SCHEMBL547819;2-(1-Naphthyl)-2-propanol #;DTXSID40285612;NSC-42476;AKOS012081279;1-(1-Hydroxy-1-methylethyl)naphthalene;s11344;AS-59360;CS-0154620;EN300-1830869

Chemical Property of 2-Naphthalen-1-ylpropan-2-ol

Chemical Property:

• Vapor Pressure: 8.39E-05mmHg at 25°C
• Melting Point: 80 °C(Solv: ligroine (8032-32-4))
• Boiling Point: 327.1°C at 760 mmHg
• PKA: 14.36±0.29(Predicted)
• Flash Point: 145.3°C
• PSA: 20.23000
• Density: 1.087g/cm³
• LogP: 3.06720
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 3.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 186.104465066
• Heavy Atom Count: 14
• Complexity: 197

Purity/Quality:

95% ^*data from raw suppliers

ALPHA,ALPHA-DIMETHYL-1-NAPHTHALENEMETHANOL Aldrich ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C1=CC=CC2=CC=CC=C21)O

Technology Process of 2-Naphthalen-1-ylpropan-2-ol

There total 21 articles about 2-Naphthalen-1-ylpropan-2-ol 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: 97.7%

1'-naphthacetophenone (941-98-0) + methyl magnesium iodide (917-64-6) → 2-(naphthalen-1-yl)propan-2-ol (6301-54-8)

Guidance literature:

In diethyl ether; for 2h; Ambient temperature;

DOI:10.1248/cpb.42.1191

Reference yield: 94.0%

1'-naphthacetophenone (941-98-0) + ethylmagnesium bromide (925-90-6) + methyllithium (917-54-4) → 2-(naphthalen-1-yl)propan-2-ol (6301-54-8) + 2-(1-naphthyl)-2-butanol (102238-70-0)

Guidance literature:

ethylmagnesium bromide; methyllithium; In tetrahydrofuran; diethyl ether; at -78 ℃; for 1h;

1'-naphthacetophenone; In tetrahydrofuran; diethyl ether; at -78 ℃; for 5h;

DOI:10.1021/ol047685i

Reference yield: 91.1%

methyllithium (917-54-4) + naphthalene-1-carbonic acid chloride (879-18-5) → 2-(naphthalen-1-yl)propan-2-ol (6301-54-8)

Guidance literature:

In diethyl ether; toluene; at 0 ℃; for 24h; Inert atmosphere;

DOI:10.3390/molecules17066424

upstream raw materials:

1'-naphthacetophenone

methyl magnesium iodide

ethyl 1-naphthoate

acetone

Downstream raw materials:

1-(propen-2-yl)naphthalene

1-isopropylnaphthalene

1-phenylnaphthalene

1-(4-methylphenyl)naphthalene