Trihexyl-[(38-trihexylsilyloxy-9,18,27,36,37,39,40,41-octaza-38-siladecacyclo[17.17.3.110,17.128,35.02,7.08,37.011,16.020,25.026,39.029,34]hentetraconta-1,3,5,7,9,11,13,15,17(41),18,20,22,24,26,28(40),29,31,33,35-nonadecaen-38-yl)oxy]silane

Base Information

• Chemical Name: Trihexyl-[(38-trihexylsilyloxy-9,18,27,36,37,39,40,41-octaza-38-siladecacyclo[17.17.3.110,17.128,35.02,7.08,37.011,16.020,25.026,39.029,34]hentetraconta-1,3,5,7,9,11,13,15,17(41),18,20,22,24,26,28(40),29,31,33,35-nonadecaen-38-yl)oxy]silane
• CAS No.: 92396-89-9
• Molecular Formula: C68H94N8O2Si3
• Molecular Weight: 1139.8
• DSSTox Substance ID: DTXSID40408783
• Nikkaji Number: J3.251.562B
• Mol file: 92396-89-9.mol

Synonyms:92396-89-9;Trihexyl-[(38-trihexylsilyloxy-9,18,27,36,37,39,40,41-octaza-38-siladecacyclo[17.17.3.110,17.128,35.02,7.08,37.011,16.020,25.026,39.029,34]hentetraconta-1,3,5,7,9,11,13,15,17(41),18,20,22,24,26,28(40),29,31,33,35-nonadecaen-38-yl)oxy]silane;AGN-PC-0LNGBH;SCHEMBL13338299;DTXSID40408783

Chemical Property of Trihexyl-[(38-trihexylsilyloxy-9,18,27,36,37,39,40,41-octaza-38-siladecacyclo[17.17.3.110,17.128,35.02,7.08,37.011,16.020,25.026,39.029,34]hentetraconta-1,3,5,7,9,11,13,15,17(41),18,20,22,24,26,28(40),29,31,33,35-nonadecaen-38-yl)oxy]silane

Chemical Property:

• Melting Point: 175-177 oC
• PSA: 102.48000
• LogP: 15.39100
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 34
• Exact Mass: 1138.68075387
• Heavy Atom Count: 81
• Complexity: 1890

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCC[Si](CCCCCC)(CCCCCC)O[Si]1(N2C3=C4C=CC=CC4=C2N=C5C6=CC=CC=C6C(=N5)N=C7N1C(=NC8=NC(=N3)C9=CC=CC=C98)C1=CC=CC=C17)O[Si](CCCCCC)(CCCCCC)CCCCCC

Technology Process of Trihexyl-[(38-trihexylsilyloxy-9,18,27,36,37,39,40,41-octaza-38-siladecacyclo[17.17.3.110,17.128,35.02,7.08,37.011,16.020,25.026,39.029,34]hentetraconta-1,3,5,7,9,11,13,15,17(41),18,20,22,24,26,28(40),29,31,33,35-nonadecaen-38-yl)oxy]silane

There total 5 articles about Trihexyl-[(38-trihexylsilyloxy-9,18,27,36,37,39,40,41-octaza-38-siladecacyclo[17.17.3.110,17.128,35.02,7.08,37.011,16.020,25.026,39.029,34]hentetraconta-1,3,5,7,9,11,13,15,17(41),18,20,22,24,26,28(40),29,31,33,35-nonadecaen-38-yl)oxy]silane 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: 93.0%

trihexylsilyl chloride (3634-67-1) + phthalocyanine silicon(IV) dichloride (19333-10-9) → bis(tri-n-hexylsilyl oxide) silicon phthalocyanine (92396-89-9)

Guidance literature:

With sodium hydroxide; Aliquat HTA-1; In chlorobenzene; at 132 ℃; for 6h; Product distribution / selectivity;

Reference yield: 56.0%

trihexylsilyl chloride (3634-67-1) + dihydroxy silicon(IV) phthalocyanine (19333-15-4) → bis(tri-n-hexylsilyl oxide) silicon phthalocyanine (92396-89-9)

Guidance literature:

With pyridine; Inert atmosphere; Reflux;

DOI:10.1016/j.jphotochem.2021.113547

Reference yield: 31.0%

triiso-butylchlorosilane (13154-25-1) + phthalocyanine silicon(IV) dichloride (19333-10-9) → bis(tri-n-hexylsilyl oxide) silicon phthalocyanine (92396-89-9)

Guidance literature:

With sodium hydroxide; In chlorobenzene; at 132 ℃; for 6h;

DOI:10.1021/acs.langmuir.9b03772

upstream raw materials:

trihexylsilyl chloride

dihydroxy silicon(IV) phthalocyanine

phthalocyanine silicon(IV) dichloride

tributylchlorosilane

Refernces

• 1、 Dickerson, Shelby D.,Ayare, Pooja J.,Vannucci, Aaron K.,Wiskur, Sheryl L.. "Exploration of silicon phthalocyanines as viable photocatalysts for organic transformations". . . Retrieved 2021/10/01.
• 2、 -. "PREPARATION OF SILICON PHTHALOCYANINES AND GERMANIUM PHTHALOCYANINES AND RELATED SUBSTANCES". Page/Page column 10-11. . Retrieved 2010/05/13.