1,3-Dichloro-2,4,6-trifluorobenzene

Base Information

• Chemical Name: 1,3-Dichloro-2,4,6-trifluorobenzene
• CAS No.: 2368-53-8
• Molecular Formula: C6H Cl2 F3
• Molecular Weight: 200.975
• Hs Code.: 2903999090
• European Community (EC) Number: 680-059-2
• DSSTox Substance ID: DTXSID30178347
• Nikkaji Number: J1.024.471D
• Wikidata: Q83048734
• Mol file: 2368-53-8.mol

Synonyms:1,3-Dichloro-2,4,6-trifluorobenzene;2368-53-8;2,4-Dichloro-1,3,5-trifluorobenzene;Benzene,2,4-dichloro-1,3,5-trifluoro-;C6HCl2F3;1,3,5-trifluoro-2,4-dichlorobenzene;Benzene, 2,4-dichloro-1,3,5-trifluoro-;SCHEMBL4453298;DTXSID30178347;MFCD00012242;AKOS007930279;DS-5260;2,4-Dichloro-1,3,5-trifluorobenzene #;D2868;FT-0606641;T70614;2,4-bis(chloranyl)-1,3,5-tris(fluoranyl)benzene;A816846

Chemical Property of 1,3-Dichloro-2,4,6-trifluorobenzene

Chemical Property:

• Vapor Pressure: 2.95mmHg at 25°C
• Melting Point: -11--10 °C
• Refractive Index: 1.487
• Boiling Point: 161.5°Cat760mmHg
• Flash Point: 76.7°C
• PSA: 0.00000
• Density: 1.595g/cm³
• LogP: 3.41070
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 199.9407399
• Heavy Atom Count: 11
• Complexity: 130

Purity/Quality:

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

1,3-Dichloro-2,4,6-trifluorobenzene ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36/37/39

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(C(=C(C(=C1F)Cl)F)Cl)F

Technology Process of 1,3-Dichloro-2,4,6-trifluorobenzene

There total 19 articles about 1,3-Dichloro-2,4,6-trifluorobenzene 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: 94.0%

3,5-dichloro-2,4,6-trifluorobenzoic acid (13656-36-5) → 1,3-dichloro-2,4,6-trifluorobenzene (2368-53-8)

Guidance literature:

With calcium sulfate polyhydrate; calcium hydroxide; In diethylene glycol; at 120 - 140 ℃;

Reference yield: 84.0%

1,3,5-trichlorotrifluorobenzene (319-88-0) → 1,3-dichloro-2,4,6-trifluorobenzene (2368-53-8)

Guidance literature:

1,3,5-trichlorotrifluorobenzene; With n-butyllithium; at -78 ℃;

With water; at -78 - 20 ℃;

DOI:10.1002/ejic.200500121

Reference yield: 79.0%

1,3,5-trichlorotrifluorobenzene (319-88-0) → 1,3,5-trifluorobenzene (372-38-3) + 1,3-dichloro-2,4,6-trifluorobenzene (2368-53-8) + 2-chloro-1,3,5-trifluorobenzene (2106-40-3)

Guidance literature:

With copper; zinc; In water; N,N-dimethyl-formamide; at 70 ℃; for 10h;

upstream raw materials:

1,3,5-trifluorobenzene

3,5-dichloro-2,4,6-trifluorobenzoic acid

1,3,5-trichlorotrifluorobenzene

hexachlorobenzene

Downstream raw materials:

(3,5-C₆Cl₂F₃)I

1,3,5-trifluorobenzene

2,4,6-trifluorobenzoic acid

2,4,6-trifluorobromobenzene

Refernces

• 1、 -. "PROCESS FOR PREPARATION OF HALO SUBSTITUTED BENZOIC ACID COMPOUND AND INTERMEDIATES THEREOF". Page/Page column 12. . Retrieved 2018/09/28.
• 2、 Casares, Juan A.,Espinet, Pablo,Martin-Alvarez, Jose M.,Martinez-Ilarduya, Jesus M.,Salas, Gorka. "Stable nickel catalysts for fast norbornene polymerization: Tuning reactivity". . p. 3825 - 3831. Retrieved 2007/10/03.