2-(3,5-Dichlorophenyl)propan-2-ol

Base Information

• Chemical Name: 2-(3,5-Dichlorophenyl)propan-2-ol
• CAS No.: 68575-35-9
• Molecular Formula: C9H10Cl2O
• Molecular Weight: 205.084
• DSSTox Substance ID: DTXSID8071697
• Nikkaji Number: J441.197H
• Wikidata: Q72467639
• Mol file: 68575-35-9.mol

Synonyms:2-(3,5-dichlorophenyl)propan-2-ol;68575-35-9;2-(3,5-DICHLOROPHENYL)-2-PROPANOL;Benzenemethanol, 3,5-dichloro-alpha,alpha-dimethyl-;Benzenemethanol, 3,5-dichloro-.alpha.,.alpha.-dimethyl-;SCHEMBL2646961;DTXSID8071697;MFCD14706701;AKOS023097407;CS-0454923;FT-0727402;3,5-dichloro-alpha,alpha-dimethylbenzyl alcohol

Chemical Property of 2-(3,5-Dichlorophenyl)propan-2-ol

Chemical Property:

• Vapor Pressure: 0.00595mmHg at 25°C
• Refractive Index: 1.55
• Boiling Point: 261.2 °C at 760 mmHg
• Flash Point: 113 °C
• PSA: 20.23000
• Density: 1.273 g/cm³
• LogP: 3.22080
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 204.0108703
• Heavy Atom Count: 12
• Complexity: 149

Purity/Quality:

≥99% ^*data from raw suppliers

2-(3,5-DICHLOROPHENYL)-2-PROPANOL ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C1=CC(=CC(=C1)Cl)Cl)O

Technology Process of 2-(3,5-Dichlorophenyl)propan-2-ol

There total 3 articles about 2-(3,5-Dichlorophenyl)propan-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: 85.0%

1,3,5-trichlorobenzene (108-70-3,63697-19-8) + isopropyl alcohol (67-63-0,8013-70-5) → 2-(3,5-dichlorophenyl)propan-2-ol (68575-35-9)

Guidance literature:

With di-tert-butyl peroxide; sodium hydrogencarbonate; In neat (no solvent); at 120 ℃; for 24h; Reagent/catalyst; Glovebox; Inert atmosphere;

DOI:10.1002/adsc.202000216

Reference yield:

methyl magnesium iodide (917-64-6) + 3,5-dichlorobenzoyl chloride (2905-62-6) → 2-(3,5-dichlorophenyl)propan-2-ol (68575-35-9)

Guidance literature:

In ethanol;

DOI:10.1021/jm00187a019

Reference yield:

→ 2-(3,5-dichlorophenyl)propan-2-ol (68575-35-9)

Guidance literature:

In diethyl ether; at -78 - 26 ℃; for 18h;

upstream raw materials:

methyl magnesium iodide

3,5-dichlorobenzoyl chloride

1,3,5-trichlorobenzene

isopropyl alcohol

Downstream raw materials:

1,3-dichloro-5-(prop-1-en-2-yl)benzene

N-[1-methyl-1-(3,5-dichlorophenyl)ethyl]amine

2-(4-Chloro-phenyl)-4-(3,5-dichloro-phenyl)-pentanoic acid

6,8-Dichloro-2-(4-chloro-phenyl)-4-methyl-3,4-dihydro-2H-naphthalen-1-one