Cyanuric chloride-13C3

Base Information

• Chemical Name: Cyanuric chloride-13C3
• CAS No.: 286013-07-8
• Molecular Formula: C₃Cl₃N₃
• Molecular Weight: 187.379
• European Community (EC) Number: 687-245-2
• DSSTox Substance ID: DTXSID10583894
• Wikidata: Q82475505
• Mol file: 286013-07-8.mol

Synonyms:Cyanuric chloride-13C3;286013-07-8;2,4,6-trichloro-(2,4,6-13C3)1,3,5-triazine;CYANURIC-13C3 CHLORIDE 99 ATOM % 13C;SCHEMBL1332087;DTXSID10583894;Cyanuric chloride-13C3, 99 atom % 13C;2,4,6-Trichloro(~13~C_3_)-1,3,5-triazine;J-017155

Chemical Property of Cyanuric chloride-13C3

Chemical Property:

• Melting Point: 145.5-148.5 °C(lit.)
• Refractive Index: 1.585
• Boiling Point: 190 °C(lit.)
• PSA: 38.67000
• Density: 1.757g/cm³
• LogP: 1.83180
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 185.925845
• Heavy Atom Count: 9
• Complexity: 69.3

Purity/Quality:

99% by CP; 99% atom 13C ^*data from raw suppliers

Cyanuric Chloride-13C3 ^*data from reagent suppliers

Safty Information:

• Hazard Codes: T+
• Statements: 21/22-26-34-42/43-43-22-14
• Safety Statements: 23-26-36/37/39-45-63-46-28

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1(=NC(=NC(=N1)Cl)Cl)Cl
• Isomeric SMILES: [13C]1(=N[13C](=N[13C](=N1)Cl)Cl)Cl
• Uses: A coupling agent used in the immobilization of microorganisms to cellulose and activation of polysaccharides.

Technology Process of Cyanuric chloride-13C3

There total 1 articles about Cyanuric chloride-13C3 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: 71.4%

[13C]cyanuric acid (201996-37-4) → [13C]cyanuric chloride (286013-07-8)

Guidance literature:

With phosphorus pentachloride; trichlorophosphate; at 115 ℃; for 24h;

DOI:10.1002/jlcr.3025

upstream raw materials:

[¹³C]cyanuric acid