Silatrane

Base Information

• Chemical Name: Silatrane
• CAS No.: 283-60-3
• Deprecated CAS: 910620-27-8
• Molecular Formula: C6H13 N O3 Si
• Molecular Weight: 175.26
• Hs Code.: 2934999023
• European Community (EC) Number: 206-004-0
• UNII: GR8P7Y2MZW
• DSSTox Substance ID: DTXSID0058352
• ChEMBL ID: CHEMBL1992781
• Mol file: 283-60-3.mol

Synonyms:silatrane;silatrane 59;silatrane 95;silatrane A;silatrane P;silatranes;silitranes

Chemical Property of Silatrane

Chemical Property:

• Vapor Pressure: 2.12mmHg at 25°C
• Melting Point: 254°C
• Boiling Point: °Cat760mmHg
• PKA: 6.61±0.20(Predicted)
• Flash Point: °C
• PSA: 30.93000
• Density: g/cm³
• LogP: -0.97950
• Storage Temp.: Hygroscopic, Refrigerator, under inert atmosphere
• Solubility.: Chloroform (Soluble), Methanol (Slightly)
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 0
• Exact Mass: 174.05864478
• Heavy Atom Count: 11
• Complexity: 111

Purity/Quality:

98%min ^*data from raw suppliers

Silatrane ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CO[Si]2OCCN1CCO2
• Uses: Silatrane can be used as a reversible cholinesterase inhibitor. Silatrane and its derivatives can also be used as antitumor agents.

Technology Process of Silatrane

There total 6 articles about Silatrane 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%

1-(2-triphenylstannylthioethyl)silatrane (101538-37-8) + 1-(γ-mercaptopropyl)silatrane (29909-46-4) → silatrane (283-60-3) + sodium chloride

Guidance literature:

With sodium methylate; In methanol; toluene;

Reference yield: 24.0%

2,8,9-trioxa-5-aza-1-borabicyclo[3.3.3]undecane (283-56-7) → silatrane (283-60-3)

Guidance literature:

With aluminum (III) chloride; Triethoxysilane; In 5,5-dimethyl-1,3-cyclohexadiene; Inert atmosphere;

DOI:10.1021/jo1017734

Reference yield: 20.0%

triethanolamine (102-71-6,64114-46-1) + Triethoxysilane (998-30-1) → silatrane (283-60-3)

Guidance literature:

In xylene; for 2h; Heating;

DOI:10.1016/0022-328X(85)80362-4

upstream raw materials:

trimethoxysilane

triethanolamine

Triethoxysilane

1-(2-triphenylstannylthioethyl)silatrane

Downstream raw materials:

[H₃Os(Si(OC₂H₄)3N)(P(C₆H₅)3)3]

[Os(Si(OC₂H₄)3N)(H)(CO)2(P(C₆H₅)3)2]

[Os(Si(OC₂H₄)3N)(H)(CO)2(P(C₆H₅)3)2]

((C₆H₅)3P)2Os(Cl)(CO)(Si(OCH₂CH₂)3N)

Refernces

• 1、 Junker, Christopher S.,Welker, Mark E.,Day, Cynthia S.. "Synthesis of 4-aryl- and 4-alkyl-2-silyl-1,3-butadienes and their Diels-Alder/cross-coupling reactions". . p. 8155 - 8165. Retrieved 2011/03/18.
• 2、 Nies, J. Dirk,Bellama, Jon M.,Ben-Zvi, Nava. "DIRECT TRANSFER OF ALIPHATIC AND AROMATIC SUBSTITUENTS FROM ORGANOSILATRANES TO MERCURY(II) SPECIES". . p. 315 - 320. Retrieved 2007/10/02.