Benzyl-PEG4-alcohol - CAS 86259-87-2
Catalog: |
BB037874 |
Product Name: |
Benzyl-PEG4-alcohol |
CAS: |
86259-87-2 |
Synonyms: |
Tetraethylene Glycol Monobenzyl Ether; 1-Phenyl-2,5,8,11-tetraoxatridecan-13-ol; BnO-PEG4-OH; 2-[2-[2-[2-(Benzyloxy)ethoxy]ethoxy]ethoxy]ethanol; 2,5,8,11-Tetraoxatridecan-13-ol, 1-phenyl-; Benzyl-PEG4-OH; 13-Phenyl-3,6,9,12-tetraoxatridecan-1-ol |
Related CAS: | 26403-74-7 (polymer) 1201808-31-2 (polymer)
|
IUPAC Name: | 2-[2-[2-(2-phenylmethoxyethoxy)ethoxy]ethoxy]ethanol |
Description: | Benzyl-PEG4-alcohol is a polyethylene glycol (PEG)-based PROTAC linker that can be used in the synthesis of a series of PROTACs. |
Molecular Weight: | 284.35 |
Molecular Formula: | C15H24O5 |
Canonical SMILES: | C1=CC=C(C=C1)COCCOCCOCCOCCO |
InChI: | InChI=1S/C15H24O5/c16-6-7-17-8-9-18-10-11-19-12-13-20-14-15-4-2-1-3-5-15/h1-5,16H,6-14H2 |
InChI Key: | QDPIVUQXPXUNLN-UHFFFAOYSA-N |
Boiling Point: | 170-174°C at 25 Torr |
Purity: | ≥95% |
Density: | 1.10±0.1 g/cm3 |
Solubility: | Soluble in Chloroform (Sparingly), DMSO (Sparingly) |
Appearance: | Light yellow clear liquid |
Storage: | Store at 2-8°C |
MDL: | MFCD06797175 |
LogP: | 1.24530 |
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 |
WO-2021055936-A1 | Small-molecule inhibitors for the β-catenin/b-cell lymphoma 9 proteinâˆ'protein interaction | 20190920 |
CN-112322401-A | Compositions and methods for cleaning urethane molds | 20190805 |
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Complexity: | 195 |
Compound Is Canonicalized: | Yes |
Covalently-Bonded Unit Count: | 1 |
Defined Atom Stereocenter Count: | 0 |
Defined Bond Stereocenter Count: | 0 |
Exact Mass: | 284.16237386 |
Formal Charge: | 0 |
Heavy Atom Count: | 20 |
Hydrogen Bond Acceptor Count: | 5 |
Hydrogen Bond Donor Count: | 1 |
Isotope Atom Count: | 0 |
Monoisotopic Mass: | 284.16237386 |
Rotatable Bond Count: | 13 |
Topological Polar Surface Area: | 57.2 Å2 |
Undefined Atom Stereocenter Count: | 0 |
Undefined Bond Stereocenter Count: | 0 |
XLogP3: | 0.4 |
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