CAS Number41024-91-3
SynonymsPentaethylene glycol di-p-toluenesulfonate; 2-[2-[2-[2-[2-(4-methylphenyl)sulfonyloxyethoxy]ethoxy]ethoxy]ethoxy]ethyl 4-methylbenzenesulfonate; MFCD00012204
Molecular FormulaCH3C6H4SO3(CH2CH2O)5SO2C6H4CH3
Molecular Weight546.65
Density1.26
Boiling Point661.4ºC at 760mmHg
Symbol
Signal WordWarning
| Chemical & Physical Properties | |
|---|---|
| CAS Number | 41024-91-3 |
| Catalog No. | 2A-2188807 |
| Chinese Name | 二对甲苯磺酸戊乙二醇 |
| Synonyms | Pentaethylene glycol di-p-toluenesulfonate; 2-[2-[2-[2-[2-(4-methylphenyl)sulfonyloxyethoxy]ethoxy]ethoxy]ethoxy]ethyl 4-methylbenzenesulfonate; MFCD00012204 |
| Molecular Formula | CH3C6H4SO3(CH2CH2O)5SO2C6H4CH3 |
| Molecular Weight | 546.65 |
| Density | 1.26 |
| Boiling Point | 661.4ºC at 760mmHg |
| Water Solubility | Not miscible or difficult to mix in water. |
| Storage Condition | Sealed, cool and dry storage |
| Application | Pentaethylene glycol di(p-toluenesulfonate) is a PROTAC linker, belonging to the PEG class. Can be used to synthesize PROTAC molecules. |
| HTC | 2909499000 |
| PubChem ID | 24858741 |
| MDL Number | MFCD00012204 |
| SMILES | Cc1ccc(S(=O)(=O)OCCOCCOCCOCCOCCOS(=O)(=O)c2ccc(C)cc2)cc1 |
| InChI | InChI=1S/C24H34O10S2/c1-21-3-7-23(8-4-21)35(25,26)33-19-17-31-15-13-29-11-12-30-14-16-32-18-20-34-36(27,28)24-9-5-22(2)6-10-24/h3-10H,11-20H2,1-2H3 |
| InChI Key | BUHGDYPBQWWWQS-UHFFFAOYSA-N |
| Beilstein/REAXYS | 3599245 |
| NACRES Code | NA.22 |
| UNSPSC | 12352100 |
| Hazard Symbols | transportation |
| Bioactivity | Pentaethylene glycol di(p-toluenesulfonate) is a PEG-based PROTAC linker that can be used in the synthesis of PROTACs[1]. Related Catalog Research Areas >> Cancer Signaling Pathways >> PROTAC >> PROTAC Linker In Vitro PROTACs contain two different ligands connected by a linker; one is a ligand for an E3 ubiquitin ligase and the other is for the target protein. PROTACs exploit the intracellular ubiquitin-proteasome system to selectively degrade target proteins[1]. References [1]. Snaebjornsson MT, et al. Non-canonical functions of enzymes facilitate cross-talk between cell metabolic and regulatory pathways. Exp Mol Med. 2018 Apr 16;50(4):34. Chemical & Physical Properties Density 1.26 Boiling Point 661.4ºC at 760mmHg Molecular Formula C24H34O10S2 Molecular Weight 546.65100 Flash Point 353.8ºC Exact Mass 546.15900 PSA 140.42000 LogP 4.64220 Index of Refraction n20/D 1.524(lit.) InChIKey BUHGDYPBQWWWQS-UHFFFAOYSA-N SMILES Cc1ccc(S(=O)(=O)OCCOCCOCCOCCOCCOS(=O)(=O)c2ccc(C)cc2)cc1 Water Solubility Not miscible or difficult to mix in water. |
| Use of | Pentaethylene glycol di(p-toluenesulfonate) is a PEG-based PROTAC linker that can be used in the synthesis of PROTACs[1]. Properties Name penta(ethylene glycol) di-p-toluenesulfonate Synonym More Synonyms Biological Activity Description Pentaethylene glycol di(p-toluenesulfonate) is a PEG-based PROTAC linker that can be used in the synthesis of PROTACs[1]. Related Catalog Research Areas >> Cancer Signaling Pathways >> PROTAC >> PROTAC Linker In Vitro PROTACs contain two different ligands connected by a linker; one is a ligand for an E3 ubiquitin ligase and the other is for the target protein. PROTACs exploit the intracellular ubiquitin-proteasome system to selectively degrade target proteins[1]. References [1]. Snaebjornsson MT, et al. Non-canonical functions of enzymes facilitate cross-talk between cell metabolic and regulatory pathways. Exp Mol Med. 2018 Apr 16;50(4):34. Chemical & Physical Properties Molecular Formula C24H34O10S2 Exact Mass 546.15900 PSA 140.42000 LogP 4.64220 InChIKey BUHGDYPBQWWWQS-UHFFFAOYSA-N Water Solubility Not miscible or difficult to mix in water. |
| Tax Rebate | 9.0% |
| Supervision | None MFN tariff: 5.5% Ordinary tariff: 30.0% |
| Transport Info | Shipping Name: UN |
| MSDS Transport Info | Module 14. Shipping information 14.1 UN dangerous goods number European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.2 United Nations shipping name European Land Transport Dangerous Regulations: Non-dangerous goods IMDG Code: Non-dangerous goods International air transport dangerous goods regulations: non-dangerous goods 14.3 Transport hazard categories European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.4 Package group European Land Transport Dangerous Regulations: -International Maritime Dangerous Regulations: -International Air Transport Dangerous Regulations: - 14.5 Environmental hazards European Land Transport Danger Regulations: No International Maritime Danger Regulations International Air Transport Danger Regulations: No Marine pollutants (yes/no): No 14.6 Special reminder to users No data available The above information is believed to be correct, but is not all-inclusive and should be used as a guide only. The information in this document is based on our current knowledge and is Correct safety instructions apply to this product. This information does not represent a warranty as to the properties of this product. See reverse side of invoice or packing slip. |
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