1,2,3-Triphenyl-2-propanol

Base Information

• Chemical Name: 1,2,3-Triphenyl-2-propanol
• CAS No.: 5472-27-5
• Molecular Formula: C21H20 O
• Molecular Weight: 288.389
• NSC Number: 27932
• DSSTox Substance ID: DTXSID70282770
• Nikkaji Number: J1.049.690J
• Wikidata: Q82017130
• Pharos Ligand ID: M84FVP8VLL9P
• ChEMBL ID: CHEMBL1410910
• Mol file: 5472-27-5.mol

Synonyms:1,2,3-triphenyl-2-propanol;NSC27932;5472-27-5;NSC-27932;NCIStruc1_000414;NCIStruc2_000605;CHEMBL1410910;DTXSID70282770;NCI27932;CCG-38055;NCGC00013344;NSC 27932;NCGC00013344-02;NCGC00096461-01;NCI60_002272

Chemical Property of 1,2,3-Triphenyl-2-propanol

Chemical Property:

• Vapor Pressure: 2.91E-07mmHg at 25°C
• Boiling Point: 404.3°Cat760mmHg
• Flash Point: 150.1°C
• Density: 1.115g/cm³
• XLogP3: 4.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 5
• Exact Mass: 288.151415257
• Heavy Atom Count: 22
• Complexity: 286

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)CC(CC2=CC=CC=C2)(C3=CC=CC=C3)O

Technology Process of 1,2,3-Triphenyl-2-propanol

There total 24 articles about 1,2,3-Triphenyl-2-propanol 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: 97.0%

phenylmagnesium chloride (100-59-4) + 1,3-Diphenylpropanone (102-04-5) → 1,2,3-triphenyl-propan-2-ol (5472-27-5)

Guidance literature:

1,3-Diphenylpropanone; With lanthanium (III) chloride bis(lithium chloride) complex; In tetrahydrofuran; Inert atmosphere;

phenylmagnesium chloride; In tetrahydrofuran; at 0 - 25 ℃; Inert atmosphere;

DOI:10.1055/s-0029-1217169

Reference yield: 88.0%

phenyl benzyl ketone (451-40-1) + benzylmagnesium chloride (6921-34-2) → 1,2,3-triphenyl-propan-2-ol (5472-27-5)

Guidance literature:

In diethyl ether; for 0.5h; Heating;

Reference yield: 75.0%

benzoic acid ethyl ester (93-89-0,99341-95-4) + benzyl bromide (100-39-0) → 1,2,3-triphenyl-propan-2-ol (5472-27-5)

Guidance literature:

With samarium; copper(l) iodide; In tetrahydrofuran; at 20 ℃; for 10h; Inert atmosphere;

DOI:10.1039/d1cc00965f

upstream raw materials:

benzoic acid ethyl ester

diethyl ether

benzyl chloride

benzoyl chloride

Downstream raw materials:

1,2,3-triphenylpropane

1,2,3-triphenyl-1-propene

phenyl benzyl ketone

deoxybenzoin sodium enolate