2,4,6-Trimethyl-1,3,5-trithiane

Base Information

• Chemical Name: 2,4,6-Trimethyl-1,3,5-trithiane
• CAS No.: 2765-04-0
• Molecular Formula: C₆H₁₂S₃
• Molecular Weight: 180.359
• Hs Code.: 2934999090
• European Community (EC) Number: 245-870-4,668-690-1
• NSC Number: 227897
• UNII: K8GLL4NEZI,4HQ3RWP831
• DSSTox Substance ID: DTXSID20863018,DTXSID901030914
• Nikkaji Number: J135.243A,J135.244J,J7.910C,J242.673K
• Wikidata: Q27259604,Q27282085
• Metabolomics Workbench ID: 45030
• Mol file: 2765-04-0.mol

Synonyms:2,4,6-TRIMETHYL-1,3,5-TRITHIANE;Trithioacetaldehyde;2765-04-0;alpha-Trithioacetaldehyde;23769-39-3;Thioacetaldehyde trimer;beta-Trithioacetaldehyde;1,3,5-Trithiane, 2,4,6-trimethyl-;2,4,6-Trimethyl-s-trithiane;s-Trithiane, 2,4,6-trimethyl-;K8GLL4NEZI;UNII-K8GLL4NEZI;(2alpha,4alpha,6alpha)-2,4,6-Trimethyl-1,3,5-trithiane;UNII-4HQ3RWP831;UNII-C6MG282Q6S;cis-2,4,6-Trimethyl-1,3,5-trithiane;Thioacetaldehyde cyclic trimer;1,3,5-Trimethyl-S-trithiane;4HQ3RWP831;cis,cis-2,4,6-Trimethyl-1,3,5-trithiane;Thioacetaldehyde beta-form [MI];EINECS 245-870-4;1,3,5-Trimethyl-2,4,6-trithiane;S-Trithiane, 2,4,6-trimethyl-, cis-2,4,cis-2,6-;23769-40-6;beta-2,4,6-Trimethyl-1,3,5-trithiane;1,3,5-Trithiane, 2,4,6-trimethyl, #1;1,3,5-Trithiane, 2,4,6-trimethyl, #2;1,3,5-Trithiane, 2,4,6-trimethyl-, (2alpha,4alpha,6alpha)-;beta-Thioacetaldehyde;alpha-Thioacetaldehyde;gamma-Thioacetaldehyde;1,5-Trimethyl-s-trithiane;2,6-Trimethyl-s-trithiane;CC1SC(C)SC(C)S1;s-Trithiane,4,6-trimethyl-;C6MG282Q6S;SCHEMBL1641407;.BETA.-TRITHIOACETALDEHYDE;C6H12S3;DTXSID20863018;CHEBI:169269;.ALPHA.-TRITHIOACETALDEHYDE;2,6-Trimethyl-1,3,5-trithiane;DTXSID901030914;2E,6E-Trimethyl-1,3,5-trithiane;C6-H12-S3;NSC227897;1,5-Trithiane, 2,4,6-trimethyl-;AKOS024337231;NSC 227897;NSC-227897;2E,4E,6E-Trimethyl-1,3,5-trithiane;2E, 4E,6E-Trimethyl-1,3,5-trithiane;THIOACETALDEHYDE .BETA.-FORM [MI];THIOACETALDEHYDE .ALPHA.- FORM [MI];2alpha,4alpha,6beta-Trimethyl-1,3,5-trithiane;A819145;TRANS-2,4,6-TRIMETHYL-1,3,5-TRITHIANE;.ALPHA.-2,4,6-TRIMETHYL-1,3,5-TRITHIANE;.BETA.-2,4,6-TRIMETHYL-1,3,5-TRITHIANE;2,4,6-Trimethyl-S-trithiane (trithioacetaldehyde);Q27259604;Q27282085;1,3,5-TRITHIANE, 2,4,6-TRIMETHYL-, (2.ALPHA.,4.ALPHA.,6.ALPHA.)-;1,3,5-TRITHIANE, 2,4,6-TRIMETHYL-, (2.ALPHA.,4.ALPHA.,6.BETA.)-

Chemical Property of 2,4,6-Trimethyl-1,3,5-trithiane

Chemical Property:

• Melting Point: 101°C
• Refractive Index: 1.5410 (estimate)
• Boiling Point: 247.8°Cat760mmHg
• Flash Point: 102.6°C
• PSA: 75.90000
• Density: 1.093g/cm³
• LogP: 3.23760
• XLogP3: 3.5
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 180.01011390
• Heavy Atom Count: 9
• Complexity: 63.3

Purity/Quality:

99%min ^*data from raw suppliers

TRITHIOACETALDEHYDE Aldrich ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1SC(SC(S1)C)C

Technology Process of 2,4,6-Trimethyl-1,3,5-trithiane

There total 2 articles about 2,4,6-Trimethyl-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:

AgNO3*2,4,6-trimethyl-{1,3,5}trithiane → 2,4,6-trimethyl-1,3,5-trithiane (2765-04-0)

Guidance literature:

With sodium chloride; In not given; heating;

Reference yield:

3AgNO3*2,4,6-trimethyl-{1,3,5}trithiane → 2,4,6-trimethyl-1,3,5-trithiane (2765-04-0)

Guidance literature:

With sodium chloride; In not given; heating;