ChemicalBook--->CAS DataBase List--->1802907-91-0

1802907-91-0

1802907-91-0 Structure

1802907-91-0 Structure
IdentificationBack Directory
[Name]

Methyltetrazine-PEG4-Acid
[CAS]

1802907-91-0
[Synonyms]

Methyltetrazine-PEG4-Acid
Methyltetrazine-PEG4-COOH
Methyltetrazine-PEG4-COOH,Methyltetrazine-PEG4-Acid
1-(4-(6-Methyl-1,2,4,5-tetrazin-3-yl)phenoxy)-3,6,9,12-tetraoxapentadecan-15-oic acid
3-(2-(2-(2-(2-(4-(6-methyl-1,2,4,5-tetrazin-3-yl)phenoxy)ethoxy)ethoxy)ethoxy)ethoxy)propanoic acid
Propanoic acid, 3-[2-[2-[2-[2-[4-(6-methyl-1,2,4,5-tetrazin-3-yl)phenoxy]ethoxy]ethoxy]ethoxy]ethoxy]-
[Molecular Formula]

C20H28N4O7
[MDL Number]

MFCD28334558
[MOL File]

1802907-91-0.mol
[Molecular Weight]

436.46
Chemical PropertiesBack Directory
[Boiling point ]

647.6±65.0 °C(Predicted)
[density ]

1.236±0.06 g/cm3(Predicted)
[storage temp. ]

Storage temp. 2-8°C
[solubility ]

Soluble in Water, DMSO, DMF, DCM
[form ]

Solid
[pka]

4.28±0.10(Predicted)
[color ]

Purple to purplish red
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P280-P301+P312-P302+P352-P305+P351+P338
Hazard InformationBack Directory
[Description]

Methyltetrazine-PEG4-Acid is a stable tetrazines molecule containing a terminal carboxylic acid (CO2H) The terminal acid can react with primary amine groups in the presence of of activators (e.g. EDC, or HATU) to form a stable amide bond. Methyltetrazine enable fast click chemistry with TCO ((trans-cycloctene), methyl group enhances the stability of tetrazine moiety.
[Uses]

Methyltetrazine-PEG4-acid is a PEG-based PROTAC linker that can be used in the synthesis of PROTACs[1].
[IC 50]

PEGs
[References]

[1] An S, et al. Small-molecule PROTACs: An emerging and promising approach for the development of targeted therapy drugs. EBioMedicine. 2018 Oct;36:553-562 DOI:10.1016/j.ebiom.2018.09.005
Spectrum DetailBack Directory
[Spectrum Detail]

Methyltetrazine-PEG4-Acid(1802907-91-0)1HNMR
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