2-Methoxyphenethyl alcohol

Base Information

• Chemical Name: 2-Methoxyphenethyl alcohol
• CAS No.: 7417-18-7
• Molecular Formula: C9H12O2
• Molecular Weight: 152.193
• Hs Code.: 29094990
• European Community (EC) Number: 231-029-9
• NSC Number: 101847
• DSSTox Substance ID: DTXSID60225136
• Nikkaji Number: J149.915G
• Wikidata: Q72517407
• Mol file: 7417-18-7.mol

Synonyms:2-(2-Methoxyphenyl)ethanol;2-Methoxyphenethyl alcohol;7417-18-7;Benzeneethanol, 2-methoxy-;MFCD00002889;Phenethyl alcohol, o-methoxy-;2-(2-methoxy-phenyl)-ethanol;EINECS 231-029-9;2-(2-Methoxyphenyl)Ethan-1-Ol;2-(2-Hydroxyethyl)-anisole;NSC101847;2-Methoxybenzeneethanol;2-(2-Hydroxyethyl)anisole;2-methoxy-phenethyl alcohol;NCIOpen2_001703;SCHEMBL852646;2-(2-Methoxyphenyl)ethanol #;DTXSID60225136;2-Methoxyphenethyl alcohol, 99%;AKOS000442202;CS-W001944;DS-5389;NSC 101847;NSC-101847;SY023218;FT-0602166;M2657;EN300-130317;A838045

Chemical Property of 2-Methoxyphenethyl alcohol

Chemical Property:

• Vapor Pressure: 0.00574mmHg at 25°C
• Melting Point: 37 °C
• Refractive Index: n20/D 1.54(lit.)
• Boiling Point: 261.8 °C at 760 mmHg
• PKA: 14.89±0.10(Predicted)
• Flash Point: 100.7 °C
• PSA: 29.46000
• Density: 1.058 g/cm³
• LogP: 1.23000
• Storage Temp.: Keep in dark place,Sealed in dry,Room Temperature
• XLogP3: 2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 3
• Exact Mass: 152.083729621
• Heavy Atom Count: 11
• Complexity: 104

Purity/Quality:

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

2-(2-Methoxyphenyl)ethanol ^*data from reagent suppliers

Safty Information:

• Safety Statements: 24/25

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: COC1=CC=CC=C1CCO
• Uses: 2-Methoxyphenethyl alcohol may be used in chemical synthesis.

Technology Process of 2-Methoxyphenethyl alcohol

There total 20 articles about 2-Methoxyphenethyl alcohol 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: 99.0%

2-methoxyphenylacetic acid (93-25-4) → 2-methoxyphenethyl alcohol (7417-18-7)

Guidance literature:

With lithium aluminium tetrahydride; In diethyl ether; for 1h; Heating;

DOI:10.1002/(SICI)1099-0690(199902)1999:2<463::AID-EJOC463>3.0.CO;2-Z

Reference yield: 82.0%

2-(2-hydroxyphenyl)ethanol (7768-28-7) + methyl iodide (74-88-4) → 2-methoxyphenethyl alcohol (7417-18-7)

Guidance literature:

With caesium carbonate; In acetone; at 0 ℃; for 0.833333h; Inert atmosphere;

Reference yield: 66.0%

2-(2-methoxyphenyl)oxirane (62717-78-6,141303-38-0) → 2-methoxyphenethyl alcohol (7417-18-7)

Guidance literature:

With tropylium tetrafluoroborate; 4,4,5,5-tetramethyl-[1,3,2]-dioxaboralane; In neat (no solvent); at 70 ℃; for 24h;

DOI:10.1021/acs.joc.1c01208

upstream raw materials:

oxirane

4-methoxyphenyl magnesium bromide

ethyl α-methoxy-α-phenylacetate

2-chloro-ethanol

Downstream raw materials:

1-(2-methoxy-phenyl)-2-(toluene-4-sulfonyloxy)-ethane

3,5-Dihydro-2-(2-hydroxyaethyl)-anisol

[2-(2-Methoxy-phenyl)-ethyl]-hydrazine

2.3-dihydrobenzofuran

Refernces

• 1、 -. "BISPHENOLATE TRANSITION METAL COMPLEXES, PRODUCTION AND USE THEREOF". Page/Page column 37-38. . Retrieved 2019/02/15.
• 2、 Imaeda, Toshihiro,Ono, Koji,Nakai, Kazuo,Hori, Yasunobu,Matsukawa, Jun,Takagi, Terufumi,Fujioka, Yasushi,Tarui, Naoki,Kondo, Mitsuyo,Imanishi, Akio,Inatomi, Nobuhiro,Kajino, Masahiro,Itoh, Fumio,Nishida, Haruyuki. "Discovery, synthesis, and structure-activity relations of 3,4-dihydro-1H-spiro(naphthalene-2,2′-piperidin)-1-ones as potassium-competitive acid blockers". . p. 3719 - 3735. Retrieved 2017/06/13.