Distannathiane, hexaphenyl-

Base Information

• Chemical Name: Distannathiane, hexaphenyl-
• CAS No.: 77-80-5
• Deprecated CAS: 38480-25-0
• Molecular Formula: C36H30 S Sn2
• Molecular Weight: 732.12
• European Community (EC) Number: 201-060-2
• UNII: 5A7YEQ5XXN
• DSSTox Substance ID: DTXSID1075355
• NSC Number: 161515
• Wikidata: Q82003317
• Mol file: 77-80-5.mol

Synonyms:Bis(triphenyltin)sulfide;Distannathiane, hexaphenyl-;77-80-5;Hexaphenyldistannathiane;triphenyl(triphenylstannylsulfanyl)stannane;NSC-161515;1,1,1,3,3,3-hexaphenyldistannathiane;Triphenyltin sulfide;Thiobis(triphenyltin);Dowco 188;Triphenylstannane sulfide;Tin, thiobis(triphenyl-;Bis(triphenylstannyl) sulfide;mu-Thiobis(triphenyltin(IV));EINECS 201-060-2;ENT 50910;NSC 161515;1,1,1,3,3,3-Hexaphenyldistannthiane;AI3-50910;DISTANNTHIANE, 1,1,1,3,3,3-HEXAPHENYL-;5A7YEQ5XXN;SCHEMBL1158027;DTXSID1075355;.mu.-Thiobis[triphenyltin(IV)];1,1,3,3,3-Hexaphenyldistannthiane;NSC161515;AKOS024429222;Distannthiane,1,1,3,3,3-hexaphenyl-;Distannathiane, 1,1,1,3,3,3-hexaphenyl-;NS00041101

Chemical Property of Distannathiane, hexaphenyl-

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Melting Point: 141-3°C
• Boiling Point: 668.105°C at 760 mmHg
• Flash Point: 357.857°C
• PSA: 25.30000
• LogP: 5.05380
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 8
• Exact Mass: 732.01063
• Heavy Atom Count: 39
• Complexity: 551

Purity/Quality:

98%min ^*data from raw suppliers

Safty Information:

• Pictogram(s): Moderately toxic by ingestion. TWA 0.1 mg(Sn)/m³; STEL 0.2 mg(Sn)/m³ (skin).
• Hazard Codes: Moderately toxic by ingestion. TWA 0.1 mg(Sn)/m3; STEL 0.2 mg(Sn)/m3 (skin).

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)[Sn](C2=CC=CC=C2)(C3=CC=CC=C3)S[Sn](C4=CC=CC=C4)(C5=CC=CC=C5)C6=CC=CC=C6

Technology Process of Distannathiane, hexaphenyl-

There total 21 articles about Distannathiane, hexaphenyl- 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: 85.0%

sodium sulfide (1313-82-2) + triphenyltin chloride (639-58-7) + tiolacetic acid (507-09-5) → bis(triphenyltin) sulfide (77-80-5)

Guidance literature:

With triethylamine; In tetrahydrofuran; THF soln. of triethylamine and thioacetic acid added to a THF soln. of PPh3SnCl and stirred for 4 h; vac. evapn.; extracted with benzene and filtered; added to a suspn. of Na2S; stirred for 3 h; filtered; evapd.; recrystd. from benzene soln. by slow evapn.; elem. anal.;

DOI:10.1016/j.poly.2008.11.033

Reference yield: 75.0%

hydrogen sulfide (7783-06-4) + triphenyltin chloride (639-58-7) → bis(triphenyltin) sulfide (77-80-5)

Guidance literature:

With triethylamine; In benzene; H2S passing (1.5 h), standing (20°C, 30 min); evapn., recrystn. (hexane); elem. anal.;

DOI:10.1007/BF02496221

Reference yield: 53.0%

sodium sulfide (1313-82-2) + triphenyltin chloride (639-58-7) → bis(triphenyltin) sulfide (77-80-5)

Guidance literature:

In water; refluxed for 2 days; distn., addn. of acetone, filtered, concd. (vac.), pptn. by addn. of H2O, filtered, dried (vac., P2O5);

DOI:10.1016/S0277-5387(00)87051-5

upstream raw materials:

(2S,5R,6R)-benzyl-3,3-dimethyl-7-oxo-6-(2-phenoxyacetamido)-4-thia-1-azabicyclo[3.2.0]heptane-2-carboxylate

triphenylstannane

carbon disulfide

prop-2-ene-1-thiol

Downstream raw materials:

Hexanethiol

(C₆H₅)3SnC(CO₂C₂H₅)CH₂C(CH₃)2

diphenyl methyl tin bromide

methyldiphenyltin(IV) iodide