2-Benzyl-1,3,5-trithiane

Base Information

Chemical Name:2-Benzyl-1,3,5-trithiane
CAS No.:24614-76-4
Molecular Formula:C₁₀H₁₂S₃
Molecular Weight:228.403
Hs Code.:
DSSTox Substance ID:DTXSID30496573
Wikidata:Q82345538
Mol file:24614-76-4.mol

Synonyms:2-Benzyl-1,3,5-trithiane;24614-76-4;DTXSID30496573

Suppliers and Price of 2-Benzyl-1,3,5-trithiane

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

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Chemical Property of 2-Benzyl-1,3,5-trithiane

Chemical Property:

XLogP3:4.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:228.01011390
Heavy Atom Count:13
Complexity:137

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1SCSC(S1)CC2=CC=CC=C2

Technology Process of 2-Benzyl-1,3,5-trithiane

There total 2 articles about 2-Benzyl-1,3,5-trithiane 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:

: 100-39-0
benzyl bromide

: 291-21-4
[1,3,5]trithiane

: 24614-76-4
2-benzyl-1,3,5-trithiane

Guidance literature:: With n-butyllithium; Yield given. Multistep reaction; 1.) THF, -40 deg C to r.t., 45 min, 2.) -20 deg C to r.t.;
DOI:10.1002/recl.19931120611

Reference yield:

: 24614-76-4
2-benzyl-1,3,5-trithiane

Guidance literature:: aus Lithiotrithian 2, Benzylbromid;

Reference yield: 60.0%

: 24614-76-4
2-benzyl-1,3,5-trithiane

: methylidynetricobalt(I)nonacarbonyl

: [Co₃(CO)6(CCH₃)(C₁₀H₁₂S₃)]

Guidance literature:: In n-heptane; byproducts: CO; (N2); reflux (5 h); filtration while hot, dissoln. (CH2Cl2), crystn. by slow diffusion of heptane into the CH2Cl2 soln.; elem. anal.;
DOI:10.1039/DT9960001875