1,4-Benzenedisulfonic acid, 2,2'-(1,2-ethenediylbis((3-sulfo-4,1-phenylene)imino(6-(diethylamino)-1,3,5-triazine-4,2-diyl)imino))bis-, hexasodium salt

Base Information

• Chemical Name: 1,4-Benzenedisulfonic acid, 2,2'-(1,2-ethenediylbis((3-sulfo-4,1-phenylene)imino(6-(diethylamino)-1,3,5-triazine-4,2-diyl)imino))bis-, hexasodium salt
• CAS No.: 41098-56-0
• Deprecated CAS: 68155-56-6,1999502-40-7
• Molecular Formula: C40H44 N12 O18 S6 . 6 Na
• Molecular Weight: 1369.14
• European Community (EC) Number: 255-217-5
• Mol file: 41098-56-0.mol

Synonyms:Tinopal CH 3669;41098-56-0;Fluorescent Brightener 357;EINECS 255-217-5;1,4-Benzenedisulfonic acid, 2,2'-(1,2-ethenediylbis((3-sulfo-4,1-phenylene)imino(6-(diethylamino)-1,3,5-triazine-4,2-diyl)imino))bis-, hexasodium salt;EC 255-217-5;1,4-Benzenedisulfonic acid,2,2'-(1,2-ethenediylbis((3-sulfo-4,1-phenylene)imino(6-(diethylamino)-1,3,5-triazine-4,2-diyl)imino))bis-,hexasodium salt;2,2'-(1,2-Ethenediyl)bis(5-((4-(diethylamino)-6-((2,5-disulfophenyl)amino)-1,3,5-triazin-2-yl)amino)benzenesulfonic acid, hexasodium salt;Hexasodium 2,2'-(vinylenebis((3-sulphonato-4,1-phenylene)imino(6-(diethylamino)-1,3,5-triazine-4,2-diyl)imino))bis(benzene-1,4-disulphonate);hexasodium;2-[[4-(diethylamino)-6-[4-[(E)-2-[4-[[4-(diethylamino)-6-(2,5-disulfonatoanilino)-1,3,5-triazin-2-yl]amino]-2-sulfonatophenyl]ethenyl]-3-sulfonatoanilino]-1,3,5-triazin-2-yl]amino]benzene-1,4-disulfonate;1,4-Benzenedisulfonic acid, 2,2'-[1,2-ethenediylbis[(3-sulfo-4,1-phenylene)imino[6-(diethylamino)-1,3,5-triazine-4,2-diyl]imino]]bis-, hexasodium salt;2,2'-Stilbenedisulfonic acid, 4,4'-bis((4-(2,5-disulfoanilino)-6-(diethylamino)-s-triazin-2-yl)amino)-, hexasodium salt;Hexasodium 2,2'-[vinylenebis[(3-sulphonato-4,1-phenylene)imino[6-(diethylamino)-1,3,5-triazine-4,2-diyl]imino]]bis(benzene-1,4-disulphonate);FluorescentBrightener357;KMPSLWWDIJFERN-PTNBLCRGSA-H;C40H38N12O18S6.6Na;C40H44N12O18S6.6Na;C40-H44-N12-O18-S6.6Na;LS-146850;W-110945;1,4-Benzenedisulfonic acid, 2,2'-(1,2-ethenediylbis((3-sulfo-4,1-phenylene)imino(6-(diethylamino)-1,3,5-triazine-4,2-diyl)imino))bis-, sodium salt (1:6);1,4-Benzenedisulfonic acid, 2,2'-[1,2-ethenediylbis[( 3-sulfo-4,1-phenylene)imino[6-(diethylamino)-1,3,5 -triazine-4,2-diyl]imino]]bis-, hexasodium salt;Hexasodium 2,2'-[vinylenebis[(3-sulphonato-4,1-phenylene)imino[6-(diethylamino)-1,3,5-triazine-4,2-diyl]imino]]bis(benzene-1,4-disul phonate)

Chemical Property of 1,4-Benzenedisulfonic acid, 2,2'-(1,2-ethenediylbis((3-sulfo-4,1-phenylene)imino(6-(diethylamino)-1,3,5-triazine-4,2-diyl)imino))bis-, hexasodium salt

Chemical Property:

• Vapor Pressure: 0-0Pa at 25℃
• PSA: 525.42000
• Density: 1.64[at 20℃]
• LogP: 9.09520
• Water Solubility.: 201.1g/L at 20℃
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 30
• Rotatable Bond Count: 16
• Exact Mass: 1304.0137451
• Heavy Atom Count: 82
• Complexity: 2380

Purity/Quality:

98%, ^*data from raw suppliers

FluorescentBrightener357(TechnicalGrade) ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CCN(CC)C1=NC(=NC(=N1)NC2=C(C=CC(=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])NC3=CC(=C(C=C3)C=CC4=C(C=C(C=C4)NC5=NC(=NC(=N5)N(CC)CC)NC6=C(C=CC(=C6)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]
• Isomeric SMILES: CCN(CC)C1=NC(=NC(=N1)NC2=C(C=CC(=C2)S(=O)(=O)[O-])S(=O)(=O)[O-])NC3=CC(=C(C=C3)/C=C/C4=C(C=C(C=C4)NC5=NC(=NC(=N5)N(CC)CC)NC6=C(C=CC(=C6)S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-])S(=O)(=O)[O-].[Na+].[Na+].[Na+].[Na+].[Na+].[Na+]
• Uses: Fluorescent (optical) brighteners are known for their characteristics of protecting baculoviruses against deactivation by UV light and enhancing the activity of these agents as microbial insecticides on hosts and semipermissive hosts. Fluorescent brighteners improve the bioinsecticidal activity of Anticarsia gemmatalis nucleopolyhedrovirus.

Technology Process of 1,4-Benzenedisulfonic acid, 2,2'-(1,2-ethenediylbis((3-sulfo-4,1-phenylene)imino(6-(diethylamino)-1,3,5-triazine-4,2-diyl)imino))bis-, hexasodium salt

There total 3 articles about 1,4-Benzenedisulfonic acid, 2,2'-(1,2-ethenediylbis((3-sulfo-4,1-phenylene)imino(6-(diethylamino)-1,3,5-triazine-4,2-diyl)imino))bis-, hexasodium salt 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: 89.0%

C32H18Cl2N10O18S6(6-)*6Na(1+) + 2,2'-iminobis[ethanol] (111-42-2) → 2,2'-(1,2-ethenediyl)bis[5-{(4-bis(2-hydroxyethyl)amino)-6-[(3,6-disulfophenyl)amino]-1,3,5-triazin-2-yl}amino]benzenesulfonic acid hexasidium salt (41098-56-0)

Guidance literature:

With sodium carbonate; at 98 ℃; for 3.5h; pH=9;

Reference yield:

L-Aspartic acid (56-84-8,25608-40-6,27881-03-4,32505-46-7,52526-39-3) + C32H18Cl2N10O18S6(6-)*6Na(1+) + 2,2'-iminobis[ethanol] (111-42-2) → C40H32N12O24S6(8-)*8Na(1+) + C40H26N12O26S6(10-)*10Na(1+) + 2,2'-(1,2-ethenediyl)bis[5-{(4-bis(2-hydroxyethyl)amino)-6-[(3,6-disulfophenyl)amino]-1,3,5-triazin-2-yl}amino]benzenesulfonic acid hexasidium salt (41098-56-0)

Guidance literature:

With sodium hydroxide; In water; at 95 - 100 ℃; for 4h; pH=8 - 9;

Reference yield:

→ 2,2'-(1,2-ethenediyl)bis[5-{(4-bis(2-hydroxyethyl)amino)-6-[(3,6-disulfophenyl)amino]-1,3,5-triazin-2-yl}amino]benzenesulfonic acid hexasidium salt (41098-56-0)

Guidance literature:

With sodium carbonate; calcium carbonate; In water; at 5 - 8 ℃; for 4h;

In water; at 60 ℃; for 2h;

In water; at 100 ℃; for 4h;

upstream raw materials:

L-Aspartic acid

2,2'-iminobis[ethanol]

Refernces

• 1、 -. "OPTICAL BRIGHTENING AGENTS FOR HIGH QUALITY INK-JET PRINTING". Paragraph 0076. . Retrieved 2016/07/27.