2-Tributylstannylbenzothiazole

Base Information

• Chemical Name: 2-Tributylstannylbenzothiazole
• CAS No.: 105445-58-7
• Molecular Formula: C19H31NSSn
• Molecular Weight: 424.238
• Hs Code.: 2934200090
• European Community (EC) Number: 807-287-9
• DSSTox Substance ID: DTXSID30396069
• Mol file: 105445-58-7.mol

Synonyms:2-Tributylstannylbenzothiazole;105445-58-7;2-(tributylstannyl)benzo[d]thiazole;2-(Tributylstannyl)-1,3-benzothiazole;1,3-benzothiazol-2-yl(tributyl)stannane;Benzothiazole, 2-(tributylstannyl)-;2-Tributylstannanyl-benzothiazole;tributylstannanylbenzothiazole;SCHEMBL226631;2-tributylstannanylbenzothiazole;2-tri-n-butylstannylbenzothiazole;DTXSID30396069;BIXRSCVOWFUPML-UHFFFAOYSA-N;2-tri-n-butylstannyl benzothiazole;MFCD01319094;2-(Tri-n-butylstannyl)-benzothiazole;AKOS015843273;GS-6433;2-(tributylstannanyl)-1,3-benzothiazole;2-(Tributylstannyl)benzo[d]thiazole, 95%;CS-0088222;FT-0677161;EN300-366813;A896005;J-001422

Chemical Property of 2-Tributylstannylbenzothiazole

Chemical Property:

• Vapor Pressure: 5.22E-07mmHg at 25°C
• Boiling Point: 424.1oC at 760 mmHg
• PKA: 0.89±0.10(Predicted)
• Flash Point: 210.3oC
• PSA: 41.13000
• Density: 1.202 g/mL at 25 °C
• LogP: 6.35240
• Storage Temp.: Keep Cold
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 10
• Exact Mass: 425.119924
• Heavy Atom Count: 22
• Complexity: 288

Purity/Quality:

98%min ^*data from raw suppliers

2-Tributylstannylbenzothiazole ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi,T,N
• Statements: 21-25-36/38-48/23/25-50/53
• Safety Statements: 36/37/39-45-60-61

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCC[Sn](CCCC)(CCCC)C1=NC2=CC=CC=C2S1

Technology Process of 2-Tributylstannylbenzothiazole

There total 3 articles about 2-Tributylstannylbenzothiazole 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: 96.0%

1,3-Benzothiazole (95-16-9) + tributyltin chloride (1461-22-9) → 2-(tri-n-butyltin)benzothiazole (105445-58-7)

Guidance literature:

1,3-Benzothiazole; With n-butyllithium; In tetrahydrofuran; hexane; at -78 ℃; for 1h; Inert atmosphere;

tributyltin chloride; In tetrahydrofuran; hexane; at 20 ℃; for 4h; Inert atmosphere;

DOI:10.1021/acs.inorgchem.1c03336

Reference yield:

tributyltin chloride (1461-22-9) → 2-(tri-n-butyltin)benzothiazole (105445-58-7)

Guidance literature:

1,3-Benzothiazole; With n-butyllithium; In tetrahydrofuran; hexane; at -78 ℃; for 0.166667h;

tributyltin chloride; In tetrahydrofuran; hexane; at -78 - 20 ℃; for 3.5h;

Reference yield:

2-iodobenzothiazole (1123-99-5) + bis(tri-n-butyltin) (813-19-4) → 2-(tri-n-butyltin)benzothiazole (105445-58-7)

Guidance literature:

With tetrakis(triphenylphosphine) palladium⁽⁰⁾; tetrabutylammomium bromide; potassium hydroxide; In water; at 100 ℃; for 0.0666667h; Microwave irradiation;

DOI:10.1002/ejoc.201402404

upstream raw materials:

tributyltin chloride

1,3-Benzothiazole

2-iodobenzothiazole

bis(tri-n-butyltin)

Downstream raw materials:

C₂₁H₁₄NOPS

C₃₄H₁₉N₂OPS₂

tert-Butyl (1-{4-[2-(1,3-benzothiazol-2-yl)-9H-imidazo[1,2-d]pyrido[2,3-b][1,4]benzodiazepin-3-yl]phenyl}cyclobutyl)carbamate

3-(1,3-benzothiazol-2-yl)-5-(3-morpholinophenyl)pyrazin-2-amine

Refernces

• 1、 Frazer, Andrew,Morales, Alma R.,Woodward, Adam W.,Tongwa, Paul,Timofeeva, Tatiana,Belfield, Kevin D.. "Luminescent fluorene-based bis-pyrazolyl aniline ligand for aluminum detection". . p. 239 - 250. Retrieved 2014.
• 2、 Liu, Xu-Guang,Sun, Wenfang. "Platinum(II) complexes bearing 2-(9,9-dihexadecyl-7-R-fluoren-2-yl)-1,10- phenanthroline ligands: Synthesis, photophysics and reverse saturable absorption". supporting information. p. 4732 - 4742. Retrieved 2013/09/24.