1,3,5-Trichloro-2-iodobenzene

Base Information

• Chemical Name: 1,3,5-Trichloro-2-iodobenzene
• CAS No.: 6324-50-1
• Molecular Formula: C6H2 Cl3 I
• Molecular Weight: 307.345
• Hs Code.: 2903999090
• NSC Number: 29082
• DSSTox Substance ID: DTXSID70979279
• Nikkaji Number: J435.711F
• Wikidata: Q72510272
• Mol file: 6324-50-1.mol

Synonyms:1,3,5-trichloro-2-iodobenzene;6324-50-1;2,4,6-Trichloroiodobenzene;1-iodo-2,4,6-trichlorobenzene;Benzene, 1,3,5-trichloro-2-iodo-;2,4,6-trichloro-1-iodobenzene;1,3,5-trichloro-2-iodo-benzene;Benzene,1,3,5-trichloro-2-iodo-;NSC29082;Te2Th;Te2-Th;SCHEMBL950545;DTXSID70979279;MFCD00052857;NSC-29082;AKOS009158354;AS-58923;AM20040914;CS-0314644;FT-0607948;E78143;A834295

Chemical Property of 1,3,5-Trichloro-2-iodobenzene

Chemical Property:

• Vapor Pressure: 0.00238mmHg at 25°C
• Melting Point: 56 °C
• Boiling Point: 297.5°C at 760 mmHg
• Flash Point: 133.7°C
• PSA: 0.00000
• Density: 2.085g/cm³
• LogP: 4.25140
• Sensitive.: Light Sensitive
• XLogP3: 4.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 0
• Rotatable Bond Count: 0
• Exact Mass: 305.82668
• Heavy Atom Count: 10
• Complexity: 108

Purity/Quality:

99.3% ^*data from raw suppliers

1,3,5-Trichloro-2-iodobenzene ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=C(C=C(C(=C1Cl)I)Cl)Cl

Technology Process of 1,3,5-Trichloro-2-iodobenzene

There total 11 articles about 1,3,5-Trichloro-2-iodobenzene 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: 91.0%

1,3,5-trichlorobenzene (108-70-3,63697-19-8) → 1,3,5-trichloro-2-iodobenzene (6324-50-1)

Guidance literature:

1,3,5-trichlorobenzene; With 2,2,6,6-tetramethyl-piperidine; n-butyllithium; In tetrahydrofuran; hexane; at -75 ℃; for 2h;

With iodine; In tetrahydrofuran; hexane; at -75 ℃;

Reference yield: 86.0%

C10H12Cl3N3 (401631-89-8) → 1,3,5-trichlorobenzene (108-70-3,63697-19-8) + 1,3,5-trichloro-2-iodobenzene (6324-50-1)

Guidance literature:

With tetrafluoroboric acid; hydrogen iodide; In acetonitrile; at 60 ℃; for 24h;

DOI:10.1055/s-2001-18072

Reference yield: 80.0%

2,4,6-trichloroaniline (634-93-5) → 1,3,5-trichloro-2-iodobenzene (6324-50-1)

Guidance literature:

With toluene-4-sulfonic acid; potassium iodide; sodium nitrite; In acetonitrile; at 20 ℃; for 0.5h;

DOI:10.1055/s-2006-958936

upstream raw materials:

diethyl ether

1,3,5-trichloro-2-iodosyl-benzene

2,4,6-trichloroaniline

acetic acid

Downstream raw materials:

2,3',4,6-tetrachlorobiphenyl

PCB 75

4,4,5,5-tetramethyl-2-(2,4,6-trichlorophenyl)-1,3,2-dioxaborolane

1,2-bis(2,4,6-trichlorophenyl) disulfide

Refernces

• 1、 Miller, Daniel K.,Bailey, Christopher A.,Sammelson, Robert E.. "Synthesis of Isoxazolines and Isoxazoles Inspired by Fipronil". . p. 2791 - 2798. Retrieved 2015/09/15.
• 2、 -. "PYRAZOLECARBOXAMIDE DERIVATIVES AND THEIR USE AS MICROBIOCIDES". Page/Page column 28-29. . Retrieved 2011/12/14.