Mal-PEG1-PFP
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Basic information
- CAS
1807530-08-0- Standard SMILES
O=C(CCOCCN1C(=O)C=CC1=O)Oc1c(F)c(F)c(F)c(F)c1F- InChIKey
ZKWVOGYIIBUFNC-UHFFFAOYSA-N- Molecular formula
- C15H10F5NO5
- Average molar mass
- 379.23 g/mol
Names & identifiers
- Preferred name
- Mal-PEG1-PFP
- IUPAC
- (2,3,4,5,6-pentafluorophenyl) 3-[2-(2,5-dioxopyrrol-1-yl)ethoxy]propanoate
- English name
- Mal-PEG1-PFP
- Molecular formula
- C15H10F5NO5
- Molecular weight
- 379.24
Names & synonyms
Mal-PEG1-PFP1807530-08-0Mal-PEG1-PFP esterMFCD26127800(2,3,4,5,6-pentafluorophenyl) 3-[2-(2,5-dioxopyrrol-1-yl)ethoxy]propanoateperfluorophenyl 3-(2-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)ethoxy)propanoate2,3,4,5,6-Pentafluorophenyl 3-[2-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)ethoxy]propanoate2,3,4,5,6-pentafluorophenyl 3-[2-(2,5-dioxo-2,5-dihydro-1H-pyrrol-1-yl)ethoxy]propanoateMal-PEG1-perfluorophenyl esterorb1989122SCHEMBL32678278SCHEMBL32678281
Show more names
Mal-amido-PEG1-PFP EsterPropanoic acid, 3-[2-(2,5-dihydro-2,5-dioxo-1H-pyrrol-1-yl)ethoxy]-, 2,3,4,5,6-pentafluorophenyl ester
C15H10F5NO5AKOS040742077BP-21837DA-55210SY423200HY-130568CS-0109198C70696
Database identifiers
- CAS
1807530-08-0
Properties
Computed structural propertiesFilling in
- XLogP
- 1.2
- Topological polar surface area
- 72.9 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 8
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 555
Physicochemical properties
- Boiling point
- 452.8 · 452.8±45.0 °C(Predicted)
- Density
- 1.541 · 1.541±0.06 g/cm3(Predicted)
- solubility
- Soluble in DCM
- pka
- -2.34 · -2.34±0.20(Predicted)
Chemistry & industry
Applications
DescriptionMal-PEG1-PFP is a PEG linker containing maleimide and PFP moieties. Maleimides are thiol-reactive and react between pH 6.5 and 7.5 to form thiolester bonds. PFP moieties are amine-reactive and are less susceptible to undergo hydrolysis. The hydrophilic PEG linker increases the water solubility of a compound in aqueous media.
UsesMal-PEG1-PFP ester is a Alkyl/ether-based PROTAC linker can be used in the synthesis of PROTACs.
Related reactions
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Compound notes
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