Zinpyr1;Zinpyr 1

Base Information

• Chemical Name: Zinpyr1;Zinpyr 1
• CAS No.: 914203-46-6
• Molecular Formula: C₄₆H₃₆Cl₂N₆O₅
• Molecular Weight: 823.735
• Nikkaji Number: J1.573.023D
• Mol file: 914203-46-6.mol

Synonyms:zinpyr-1;ZP1 cpd

Chemical Property of Zinpyr1;Zinpyr 1

Chemical Property:

• XLogP3: 3.2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 11
• Rotatable Bond Count: 14
• Exact Mass: 822.2124237
• Heavy Atom Count: 59
• Complexity: 1540

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1=CC=C(C(=C1)C2=C3C=C(C(=O)C(=C3OC4=C(C(=C(C=C24)Cl)O)CN(CC5=CC=CC=N5)CC6=CC=CC=N6)CN(CC7=CC=CC=N7)CC8=CC=CC=N8)Cl)C(=O)O

Technology Process of Zinpyr1;Zinpyr 1

There total 6 articles about Zinpyr1;Zinpyr 1 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: 46.8%

formaldehyd (50-00-0,30525-89-4,61233-19-0) + bis[(2-pyridyl)methyl]amine (1539-42-0) + 2',7'-dichlorofluorescein (76-54-0) → 9-(o-carboxyphenyl)-2,7-dichloro-4,5-bis[bis(2-pyridylmethyl)-aminomethyl]-6-hydroxy-3-xanthanone (914203-46-6)

Guidance literature:

formaldehyd; bis[(2-pyridyl)methyl]amine; In acetonitrile; for 0.5h; Heating;

2',7'-dichlorofluorescein; In water; acetonitrile; for 24h; Further stages.; Heating;

DOI:10.1021/ja010059l

Reference yield: 46.0%

formaldehyd (50-00-0,30525-89-4,61233-19-0) + 2,7-dichlorofluorescein (18362-80-6) + bis[(2-pyridyl)methyl]amine (1539-42-0) → 9-(o-carboxyphenyl)-2,7-dichloro-4,5-bis[bis(2-pyridylmethyl)-aminomethyl]-6-hydroxy-3-xanthanone (914203-46-6)

Guidance literature:

In water; acetonitrile; Heating;

DOI:10.1021/ja000868p

Reference yield:

4',5'-bis((bis(pyridin-2-ylmethyl)amino)methyl)-2',7'-dichloro-3',6'-bis((2-nitrobenzyl)oxy)-3Hspiro[isobenzofuran-1,9'-xanthen]-3-one → 9-(o-carboxyphenyl)-2,7-dichloro-4,5-bis[bis(2-pyridylmethyl)-aminomethyl]-6-hydroxy-3-xanthanone (914203-46-6)

Guidance literature:

In tetrahydrofuran; for 0.0666667h; pH=7; Reagent/catalyst; Time; Wavelength; Irradiation;

DOI:10.1021/jacs.7b12766

upstream raw materials:

formaldehyd

2,7-dichlorofluorescein

bis[(2-pyridyl)methyl]amine

2',7'-dichlorofluorescein