2,4-Dichlorophenyl cyanate

Base Information

• Chemical Name: 2,4-Dichlorophenyl cyanate
• CAS No.: 1601-46-3
• Molecular Formula: C7H3Cl2NO
• Molecular Weight: 188.013
• DSSTox Substance ID: DTXSID60538253
• Wikidata: Q82413544
• Mol file: 1601-46-3.mol

Synonyms:2,4-Dichlorophenyl cyanate;(2,4-dichlorophenyl) cyanate;1601-46-3;Cyanic acid, 2,4-dichlorophenyl ester;SCHEMBL9351955;DTXSID60538253;Cyanic acid,2,4-dichlorophenyl ester

Chemical Property of 2,4-Dichlorophenyl cyanate

Chemical Property:

• XLogP3: 3.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 186.9591691
• Heavy Atom Count: 11
• Complexity: 177

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=C1Cl)Cl)OC#N

Technology Process of 2,4-Dichlorophenyl cyanate

There total 1 articles about 2,4-Dichlorophenyl cyanate 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:

→ 2,4-dichloro-1-cyanato-benzene (1601-46-3)

Guidance literature:

/BRN= 210795/ in Aceton 1) NaN3 in wss. Aceton, -5grad; 2) Zers. bei 20grad;

Reference yield: 65.0%

methyl-[1,2,3,4]thiatriazol-5-yl-amine (52098-72-3) + 2,4-dichloro-1-cyanato-benzene (1601-46-3) → 1-[3-(2,4-Dichloro-phenoxy)-[1,2,4]thiadiazol-5-yl]-2-(2,4-dichloro-phenyl)-1-methyl-isourea (94295-58-6)

Guidance literature:

In acetone; Ambient temperature;

DOI:10.1021/jo00208a028

Reference yield: 48.0%

2,4-dichloro-1-cyanato-benzene (1601-46-3) + malonoyl dichloride (1663-67-8) → 5-Chlor-1,2-dihydro-2,3-dioxo-3H-pyrano<4,3-b>azet-1-carbonsaeure-(2,4-dichlorphenylester) (97333-77-2)

Guidance literature:

In 1,4-dioxane; for 36h; Ambient temperature;

Downstream raw materials:

2-(2,4-dichloro-phenoxy)-6,7-dihydro-5H-cyclopenta[e][1,3]oxazin-4-one

1-[3-(2,4-Dichloro-phenoxy)-[1,2,4]thiadiazol-5-yl]-2-(2,4-dichloro-phenyl)-1-methyl-isourea

7-Chlor-2-(2,4-dichlorphenoxy)-4H,5H-pyrano<3,4-e><1,3>oxazin-4,5-dion

5-Chlor-1,2-dihydro-2,3-dioxo-3H-pyrano<4,3-b>azet-1-carbonsaeure-(2,4-dichlorphenylester)

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