4-(1-Hydroxy-1,2-diphenylethyl)phenol

Base Information

• Chemical Name: 4-(1-Hydroxy-1,2-diphenylethyl)phenol
• CAS No.: 355803-76-8
• Molecular Formula: C20H18 O2
• Molecular Weight: 290.362
• Hs Code.: 2907299090
• DSSTox Substance ID: DTXSID80401218
• Mol file: 355803-76-8.mol

Synonyms:355803-76-8;4-(1-hydroxy-1,2-diphenylethyl)phenol;1,2-DIPHENYL-1-(4-HYDROXYPHENYL)ETHANOL;DTXSID80401218;AKOS030241997;CS-0451598;FT-0667659

Chemical Property of 4-(1-Hydroxy-1,2-diphenylethyl)phenol

Chemical Property:

• Vapor Pressure: 5.63E-09mmHg at 25°C
• Melting Point: 135-137°C
• Refractive Index: 1.641
• Boiling Point: 452.5°C at 760 mmHg
• PKA: 10.77±0.10(Predicted)
• Flash Point: 210.1°C
• PSA: 40.46000
• Density: 1.195g/cm³
• LogP: 3.87080
• XLogP3: 4.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 4
• Exact Mass: 290.130679813
• Heavy Atom Count: 22
• Complexity: 323

Purity/Quality:

1,2-Diphenyl-1-(4-hydroxyphenyl)ethanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)CC(C2=CC=CC=C2)(C3=CC=C(C=C3)O)O
• Uses: 1,2-Diphenyl-1-(4-hydroxyphenyl)ethanol (cas# 355803-76-8) is a compound useful in organic synthesis.

Technology Process of 4-(1-Hydroxy-1,2-diphenylethyl)phenol

There total 2 articles about 4-(1-Hydroxy-1,2-diphenylethyl)phenol 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: 86.0%

4-Hydroxybenzophenone (1137-42-4) + benzylmagnesium chloride (6921-34-2) → (+/-)-[1-(4-hydroxyphenyl)]-1,2-diphenylethanol (355803-76-8)

Guidance literature:

4-Hydroxybenzophenone; benzylmagnesium chloride; In tetrahydrofuran; at 0 - 20 ℃; for 24h; Inert atmosphere;

With ammonium chloride; In tetrahydrofuran; Saturated solution;

DOI:10.1016/j.ejmech.2012.05.034

Reference yield: 85.0%

benzyl bromide (100-39-0) + 4-Hydroxybenzophenone (1137-42-4) → (+/-)-[1-(4-hydroxyphenyl)]-1,2-diphenylethanol (355803-76-8) + 1,1'-(1,2-ethanediyl)bisbenzene (103-29-7)

Guidance literature:

benzyl bromide; With magnesium; In tetrahydrofuran; for 1.33333h; Heating;

4-Hydroxybenzophenone; In tetrahydrofuran; at 20 ℃; for 1.08333h;

DOI:10.1021/tx020090g

Reference yield: 97.0%

(+/-)-[1-(4-hydroxyphenyl)]-1,2-diphenylethanol (355803-76-8) → (E,Z)-1-bromo-2-[(4-hydroxy)phenyl]-1,2-diphenylethene (874504-11-7,97151-00-3)

Guidance literature:

With bromine; In tetrachloromethane; at 20 ℃; for 1.08333h;

DOI:10.1021/tx020090g

upstream raw materials:

4-Hydroxybenzophenone

benzylmagnesium chloride

benzyl bromide

Downstream raw materials:

(cis/trans)-1-chloro-2-(4-hydroxyphenyl)-1,2-diphenyl-ethene

E,Z-1-bromo-1,2-diphenyl-2-(4-hydroxyphenyl)ethene

(E,Z)-1-bromo-2-[(4-hydroxy)phenyl]-1,2-diphenylethene

(E,Z)-1-bromo-2-[4-(2-aminoethoxy)phenyl]-1,2-diphenylethene

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