3,5-diethyl-1,2,4-trithiolane (CAS 54644-28-9) — formula C6H12S3, molecular weight 180.01 g/mol; category organic chemicals.
3,5-diethyl-1,2,4-trithiolane (CAS 54644-28-9) is a organic chemicals. Its molecular formula C6H12S3 comprises 6 C, 12 H, 3 S atoms. Its molecular weight is about 180.01 g/mol. Reported physicochemical data: boiling point around 70-72 °C (1 mm Hg), LogP about 3.4. Organic chemicals are the largest family of carbon-based compounds, widely used across pharmaceuticals, agrochemicals, materials, cosmetics and food industries. Downstream uses span pharmaceutical ingredients, agrochemicals, dyes, solvents, surfactants, food additives and polymer materials. As a sourcing and distribution partner we help locate and compare this item across domestic and cross-border channels, arranging samples and batch orders with full COA and compliance files.
| CAS Number | 54644-28-9 |
|---|---|
| Molecular Formula | C6H12S3 |
| Molecular Weight | 180.01 g/mol |
| Boiling Point | 70-72 °C (1 mm Hg) |
| LogP | 3.4 |
| Packaging | 25/50kg woven bags, 20/25/50kg fibre drums, 200kg plastic drums, 1000kg IBC (subject to order confirmation) |
| Applications | 5-diethyl-1, agrochemicals, dyes, solvents, food additives and polymer materials. As a sourcing and distribution partner we can help locate and compare this item across domestic and cross-border channels, with COA and compliance files provided before ordering |
| Category | Organic Chemicals|Flavors |
Documented applications: 5-diethyl-1, agrochemicals, dyes, solvents, food additives and polymer materials. As a sourcing and distribution partner we can help locate and compare this item across domestic and cross-border channels, with COA and compliance files provided before ordering.
3,5-diethyl-1,2,4-trithiolane is a carbon-based organic compound with CAS registry number 54644-28-9 and molecular formula C6H12S3 (molecular weight 180.01 g/mol), belonging to the organic chemicals segment of chemical raw materials.
CAS number: 54644-28-9
Its molecular formula C6H12S3 comprises 6 C, 12 H, 3 S atoms.
Also known as: 3,5-diethyl-1,2,4-trithiolane · 3,5-二乙基-1,2,4-三硫杂环戊烷
Category: organic chemicals / food flavors
The CAS registry number of 3,5-diethyl-1,2,4-trithiolane is 54644-28-9.
Molecular formula C6H12S3, molecular weight 180.01 g/mol.
It is also registered under: 3,5-diethyl-1,2,4-trithiolane, 3,5-二乙基-1,2,4-三硫杂环戊烷.
Recorded applications: 5-diethyl-1, agrochemicals, dyes, solvents, food additives and polymer materials. As a sourcing and distribution partner we can help locate and compare this item across domestic and cross-border channels, with COA and compliance files provided before ordering.
Category: Organic Chemicals / Flavors.
Packaging is agreed per order, from lab-scale packs to bulk, and confirmed with each order rather than fixed on the page. A Certificate of Analysis (COA) ships with every batch and MSDS is available; where the end use carries a regulatory limit (food contact, pharmaceutical or cosmetic), state the standard at enquiry and the grade is set against it.
Independent reference data for 3,5-diethyl-1,2,4-trithiolane (CAS 54644-28-9), compiled from public chemistry databases.
| CAS Registry Number | 54644-28-9 |
|---|---|
| PubChem CID | 520895 |
| Molecular formula | C6H12S3 |
| Molecular weight | 180.01 g/mol |
| IUPAC name | 3,5-diethyl-1,2,4-trithiolane |
| InChIKey | WQXXXHMEBYGSBG-UHFFFAOYSA-N |
| UNII (FDA) | 2X9PB2D782 |
| FEMA number | 4030 |
| JECFA number | 1686 |
| Molecular Weight | 180.4 |
|---|---|
| XLogP3 | 3.4 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 3 |
| Rotatable Bond Count | 2 |
| Exact Mass | 180.01011390 |
| Monoisotopic Mass | 180.01011390 |
| Topological Polar Surface Area | 75.9 |
| Heavy Atom Count | 9 |
| Boiling Point | 70-72 °C (1 mm Hg) |
|---|---|
| Density | 1.147-1.160 |
| Refractive Index | 1.558-1.570 |
3,5-Diethyl-1,2,4-trithiolane; 54644-28-9; 1,2,4-Trithiolane, 3,5-diethyl-; FEMA No. 4030; 2X9PB2D782; DTXSID60969922; RefChem:486794; DTXCID20219899; (+-)-3,5-DIETHYL-1,2,4-TRITHIOLANE; 3,5-DIETHYL-1,2,4-TRITHIOLANE, (+-)-; 639-067-1; 957-350-0; (+/-)-3,5-Diethyl-1,2,4-trithiolane; UNII-2X9PB2D782; 3,5-Diethyl-1,2,4-trithiolane, (+/-)-; (+/-)-cis-and trans-3,5-Diethyl-1,2,4-trithiolane [FIFH]
| Regulatory & Food Contact | EU Flavoring substances FDA Substance added to food: FLAVORING AGENT OR ADJUVANT Flavoring Agents FLAVOURING_AGENT: Flavouring Agent Savory No safety concern at current levels of intake when used as a flavouring agent |
|---|---|
| GHS notification summary | 100% (89 / 89) |
| GHS notification summary | 100% (89 / 89) |
|---|
This chemical does not meet GHS hazard criteria for 100% (89 of 89) of all reports.
Reported as not meeting GHS hazard criteria by 89 of 89 companies. For more detailed information, please visit ECHA C&L website.
3,5-diethyl-1,2,4-trithiolane is identified by CAS 54644-28-9, molecular formula C6H12S3 and molecular weight 180.01 g/mol. UNII 2X9PB2D782; InChIKey WQXXXHMEBYGSBG-UHFFFAOYSA-N. Boiling Point: 70-72 °C (1 mm Hg); Density: 1.147-1.160; Refractive Index: 1.558-1.570.
Source: PubChem / Wikidata; the batch COA governs where values differ.
Supplier: Jinan Shenghe Chemical Co., Ltd.
中文页面: 3,5-二乙基-1,2,4-三硫杂环戊烷