2-((4-((4,6-Dichloro-1,3,5-triazin-2-yl)amino)phenyl)sulphonyl)ethyl hydrogen sulphate

Base Information

• Chemical Name: 2-((4-((4,6-Dichloro-1,3,5-triazin-2-yl)amino)phenyl)sulphonyl)ethyl hydrogen sulphate
• CAS No.: 52610-09-0
• Molecular Formula: C11H10 Cl2 N4 O6 S2
• Molecular Weight: 429.262
• European Community (EC) Number: 258-042-2
• DSSTox Substance ID: DTXSID00967043
• Nikkaji Number: J295.747G
• Mol file: 52610-09-0.mol

Synonyms:52610-09-0;EINECS 258-042-2;2-((4-((4,6-Dichloro-1,3,5-triazin-2-yl)amino)phenyl)sulphonyl)ethyl hydrogen sulphate;2-[[4-[(4,6-dichloro-1,3,5-triazin-2-yl)amino]phenyl]sulphonyl]ethyl hydrogen sulphate;C11H10Cl2N4O6S2;SCHEMBL12147044;DTXSID00967043;C11-H10-Cl2-N4-O6-S2;2-{4-[(4,6-Dichloro-1,3,5-triazin-2-yl)amino]benzene-1-sulfonyl}ethyl hydrogen sulfate;Sulfuric acid 2-[4-(4,6-dichloro-1,3,5-triazine-2-ylamino)phenylsulfonyl]ethyl ester;Ethanol, 2-((4-((4,6-dichloro-1,3,5-triazin-2-yl)amino)phenyl)sulfonyl)-, hydrogen sulfate (ester)

Chemical Property of 2-((4-((4,6-Dichloro-1,3,5-triazin-2-yl)amino)phenyl)sulphonyl)ethyl hydrogen sulphate

Chemical Property:

• PSA: 165.20000
• Density: 1.772g/cm³
• LogP: 3.74970
• XLogP3: 1.9
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 10
• Rotatable Bond Count: 7
• Exact Mass: 427.9418818
• Heavy Atom Count: 25
• Complexity: 620

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC(=CC=C1NC2=NC(=NC(=N2)Cl)Cl)S(=O)(=O)CCOS(=O)(=O)O

Technology Process of 2-((4-((4,6-Dichloro-1,3,5-triazin-2-yl)amino)phenyl)sulphonyl)ethyl hydrogen sulphate

There total 1 articles about 2-((4-((4,6-Dichloro-1,3,5-triazin-2-yl)amino)phenyl)sulphonyl)ethyl hydrogen sulphate 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-(p-aminophenylsulfonyl)ethyl hydrogen sulfate (2494-89-5) + 1,3,5-trichloro-2,4,6-triazine (108-77-0) → C11H10Cl2N4O6S2 (52610-09-0)

Guidance literature:

With sodium hydroxide; disodium hydrogenphosphate; In water; at 0 ℃; pH=3 - 4;

Reference yield: 28.7%

C11H10Cl2N4O6S2 (52610-09-0) + C24H26N10O10S5 → C46H44Cl2N18O22S9

Guidance literature:

C₁₁H₁₀Cl₂N₄O₆S₂; C₂₄H₂₆N₁₀O₁₀S₅; With sodium carbonate; In water; at 45 - 50 ℃; for 4h; pH=6.5 - 7.5;

With hydrogenchloride; potassium chloride; In water; for 2h; pH=5;

Reference yield: 24.0%

C11H10Cl2N4O6S2 (52610-09-0) + C26H26N10O14S5 → C48H44Cl2N18O26S9

Guidance literature:

C₂₆H₂₆N₁₀O₁₄S₅; With sodium carbonate; In water; at 45 - 50 ℃; pH=7 - 7.5;

C₁₁H₁₀Cl₂N₄O₆S₂; With sodium carbonate; In water; for 4h; pH=6.5 - 7;

With hydrogenchloride; potassium chloride; In water; pH=5;

upstream raw materials:

2-(p-aminophenylsulfonyl)ethyl hydrogen sulfate

1,3,5-trichloro-2,4,6-triazine

Downstream raw materials:

C₁₇H₁₇ClN₆O₉S₃

C₃₁H₂₄ClN₇O₁₅S₅

Refernces

• 1、 -. "Preparation method for reaction red dye". Paragraph 0020; 0021; 0045; 0046; 0066; 0078. . Retrieved 2018/04/02.
• 2、 Shan, Bin,Tong, Xing,Xiong, Wei,Qiu, Wenzhu,Tang, Bingtao,Lu, Rongwen,Ma, Wei,Luo, Yi,Zhang, Shufen. "A new kind of H-acid monoazo-anthraquinone reactive dyes with surprising colour". . p. 44 - 54. Retrieved 2015/09/01.