2-(4-(Oxiran-2-ylmethoxy)phenyl)ethanol

Base Information

• Chemical Name: 2-(4-(Oxiran-2-ylmethoxy)phenyl)ethanol
• CAS No.: 104857-48-9
• Molecular Formula: C11H14 O3
• Molecular Weight: 194.23
• DSSTox Substance ID: DTXSID40439572
• Nikkaji Number: J2.419.064A
• Mol file: 104857-48-9.mol

Synonyms:104857-48-9;2-(4-(Oxiran-2-ylmethoxy)phenyl)ethanol;4-(2-Oxiranylmethoxy)-benzeneethanol;2-[4-(oxiran-2-ylmethoxy)phenyl]ethanol;4-(2-Oxiranylmethoxy)benzeneethanol;1-[4-(2-Hydroxyethyl)phenoxy]-2,3-epoxypropane;starbld0017076;SCHEMBL3459148;DTXSID40439572;XGTFFRCLROZLAD-UHFFFAOYSA-N;2-[4-(Glycidyloxy)phenyl]ethanol;4-(Oxiranylmethoxy)-benzeneethanol;AKOS015891595;AC-30588;CS-0339642;FT-0673345;2-(4-(Oxiran-2-ylmethoxy)phenyl)ethan-1-ol;A24900;D88167;2-{4-[(Oxiran-2-yl)methoxy]phenyl}ethan-1-ol;1-[4-(2-hydroxyethyl)phenoxyl]-2,3-epoxypropane;2-{4-[(OXIRAN-2-YL)METHOXY]PHENYLETHAN-1-OL

Chemical Property of 2-(4-(Oxiran-2-ylmethoxy)phenyl)ethanol

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Melting Point: 57-58℃
• Refractive Index: 1.558
• Boiling Point: 338.569°C at 760 mmHg
• PKA: 14.92±0.10(Predicted)
• Flash Point: 158.561°C
• PSA: 41.99000
• Density: 1.183
• LogP: 0.99900
• Solubility.: Acetone, Chloroform (Slightly)
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 5
• Exact Mass: 194.094294304
• Heavy Atom Count: 14
• Complexity: 164

Purity/Quality:

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

4-(2-Oxiranylmethoxy)benzeneethanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1C(O1)COC2=CC=C(C=C2)CCO
• Uses: 4-(2-Oxiranylmethoxy)benzeneethanol (cas# 104857-48-9) is a compound useful in organic synthesis.

Technology Process of 2-(4-(Oxiran-2-ylmethoxy)phenyl)ethanol

There total 1 articles about 2-(4-(Oxiran-2-ylmethoxy)phenyl)ethanol 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: 100.0%

p-hydroxyphenethyl alcohol (501-94-0) + epichlorohydrin (106-89-8,24969-06-0,13403-37-7) → 1-[4-(2-hydroxyethyl)phenoxy]-2,3-epoxypropane (104857-48-9)

Guidance literature:

With potassium carbonate; In toluene; acetonitrile;

Reference yield: 57.4%

3,6-dichlorpyridazine (141-30-0) + 1-[4-(2-hydroxyethyl)phenoxy]-2,3-epoxypropane (104857-48-9) → 3-Chloro-6-[2-(4-oxiranylmethoxy-phenyl)-ethoxy]-pyridazine (160951-24-6)

Guidance literature:

With sodium hydride; In benzene; for 1h; Heating;

DOI:10.1248/cpb.42.1609

Reference yield: 42.0%

1-[4-(2-hydroxyethyl)phenoxy]-2,3-epoxypropane (104857-48-9) → (S)-1-[4-(2-hydroxyethyl)phenoxy]-2,3-epoxypropane (297741-05-0) + 3-[4-(2-hydroxy-ethyl)-phenoxy]-propane-1,2-diol + 3-[4-(2-hydroxy-ethyl)-phenoxy]-propane-1,2-diol

Guidance literature:

With water; (R,R) salen Co(III)OAc; In isopropyl alcohol; at 20 ℃; for 20h; Title compound not separated from byproducts;

DOI:10.1016/j.tet.2006.12.016

upstream raw materials:

p-hydroxyphenethyl alcohol

epichlorohydrin

Downstream raw materials:

3-Chloro-6-[2-(4-oxiranylmethoxy-phenyl)-ethoxy]-pyridazine

(S)-1-[4-(2-hydroxyethyl)phenoxy]-2,3-epoxypropane

(S)-2-[4-(2-cyclopropylmethoxy ethyl)phenoxymethyl]oxirane

(R)-1-iodo-3-[4-(2-methoxy ethyl)phenoxy]propan-2-ol

Refernces

• 1、 -. "Preparation method and application of 1-[(4-hydroxyethyl) phenoxy]-3-(isopropylamino) propan-2-ol". Paragraph 0019-0021. . Retrieved 2020/10/04.
• 2、 Zhang, Jing-Yu,Liu, Hong-Min,Xu, Hai-Wei,Shan, Li-Hong. "Non-enzymatic kinetic resolution of β-amino alcohols using C-12 higher carbon sugar as a chiral auxiliary". . p. 512 - 517. Retrieved 2008/09/19.