Triethylene glycol di(p-toluenesulfonate) - CAS 19249-03-7
Catalog: |
BB014888 |
Product Name: |
Triethylene glycol di(p-toluenesulfonate) |
CAS: |
19249-03-7 |
Synonyms: |
Tos-PEG4-Tos; Tos-PEG3-Tos; (Ethane-1,2-diylbis(oxy))bis(ethane-2,1-diyl) bis(4-Methylbenzenesulfonate); Tri(Ethylene Glycol) Di-P-Toluenesulfonate; Triethylene glycol di(p-toluenesulfonate); Triethylene glycol ditosylate; Triethylene Glycol Bis(p-toluenesulfonate); 2,2'-(Ethylenedioxy)diethyl ditosylate; Ethanol, 2,2'-[1,2-ethanediylbis(oxy)]bis-, bis(4-methylbenzenesulfonate); 1,8-Bis(tosyloxy)-3,6-dioxaoctane; NSC244980; 1,10-Ditosyl-1,4,7,10-tetraoxadecane; 1,2-Bis(2-tosyloxyethoxy)ethane |
IUPAC Name: | 2-[2-[2-(4-methylphenyl)sulfonyloxyethoxy]ethoxy]ethyl 4-methylbenzenesulfonate |
Description: | Triethylene glycol di(p-toluenesulfonate) is a polyethylene glycol (PEG)-based PROTAC linker that can be used in the synthesis of a series of PROTACs. |
Molecular Weight: | 458.55 |
Molecular Formula: | C20H26O8S2 |
Canonical SMILES: | CC1=CC=C(C=C1)S(=O)(=O)OCCOCCOCCOS(=O)(=O)C2=CC=C(C=C2)C |
InChI: | InChI=1S/C20H26O8S2/c1-17-3-7-19(8-4-17)29(21,22)27-15-13-25-11-12-26-14-16-28-30(23,24)20-9-5-18(2)6-10-20/h3-10H,11-16H2,1-2H3 |
InChI Key: | KCONMNWPRXAWKK-UHFFFAOYSA-N |
Boiling Point: | 608.4±55.0°C at 760 mmHg |
Melting Point: | 78-82°C |
Purity: | ≥95% |
Density: | 1.281±0.1 g/cm3 |
Solubility: | Soluble in Ethanol |
Appearance: | White powder |
Storage: | Store at 2-8°C |
MDL: | MFCD00048096 |
LogP: | 4.60900 |
GHS Hazard Statement: | H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation] |
Precautionary Statement: | P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501 |
Signal Word: | Warning |
Publication Number | Title | Priority Date |
CN-113004155-A | Preparation method of alpha, omega-diamino nonaethylene glycol | 20210302 |
CN-112457489-A | Functional polyquaternium and preparation method thereof | 20201209 |
CN-112538041-A | Bimolecular indole-2, 3-dione derivative and application thereof | 20201207 |
CN-112175528-A | High-stability instant adhesive and preparation method thereof | 20201014 |
CN-111909163-A | Quinolamine compound with IDO1 inhibition function and preparation method thereof | 20200421 |
PMID | Publication Date | Title | Journal |
18786850 | 20090101 | A new family of Ru(II) polypyridyl complexes containing open-chain crown ether for Mg2+ and Ca2+ probing | Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy |
21201679 | 20080806 | 1,2-Bis[2-(2-nitro-1H-imidazol-1-yl)eth-oxy]ethane | Acta crystallographica. Section E, Structure reports online |
Complexity: | 605 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 458.10691013 |
Formal Charge: | 0 |
Heavy Atom Count: | 30 |
Hydrogen Bond Acceptor Count: | 8 |
Hydrogen Bond Donor Count: | 0 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 458.10691013 |
Rotatable Bond Count: | 13 |
Topological Polar Surface Area: | 122 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 2.6 |
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