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1427004-19-0

1427004-19-0 Structure

1427004-19-0 Structure
IdentificationBack Directory
[Name]

DBCO-PEG4-SE
[CAS]

1427004-19-0
[Synonyms]

DBCO-PEG4-SE
DBCO-PEG4-SPA
DBCO-PEG4-NHS ester
DBCO-CONH-PEG4-NHS ester
DBCO-PEG4-succinimidyl ester
Dibenzocyclooctyne-PEG4-N-hydroxysuccinimidyl ester
2,5-Dioxo-1-pyrrolidinyl 20-(11,12-didehydrodibenz[b,f]azocin-5(6H)-yl)-17,20-dioxo-4,7,10,13-tetraoxa-16-azaeicosanoate
4,7,10,13-Tetraoxa-16-azaeicosanoic acid, 20-(11,12-didehydrodibenz[b,f]azocin-5(6H)-yl)-17,20-dioxo-, 2,5-dioxo-1-pyrrolidinyl ester
[Molecular Formula]

C34H39N3O10
[MDL Number]

MFCD26793797
[MOL File]

1427004-19-0.mol
[Molecular Weight]

649.69
Chemical PropertiesBack Directory
[density ]

1.33±0.1 g/cm3(Predicted)
[storage temp. ]

-20°C
[solubility ]

Soluble in DMSO, DCM, DMF
[form ]

gel or oil
[pka]

15.14±0.46(Predicted)
[color ]

Colourless to yellow
[InChIKey]

RRCXYKNJTKJNTD-UHFFFAOYSA-N
[SMILES]

C(ON1C(=O)CCC1=O)(=O)CCOCCOCCOCCOCCNC(=O)CCC(N1CC2=CC=CC=C2C#CC2=CC=CC=C12)=O
Safety DataBack Directory
[Symbol(GHS) ]

Exclamation Mark (GHS07)
GHS07
[Signal word ]

Warning
[Hazard statements ]

H302-H315-H319-H335
[Precautionary statements ]

P261-P305+P351+P338
[WGK Germany ]

3
[HS Code ]

2942000090
Hazard InformationBack Directory
[Description]

DBCO-PEG4-NHS Ester is a click chemistry PEG reagent containing NHS ester that is able to react specifically and efficiently with primary amines (e.g. the side chain of lysine residues or aminosilane-coated surfaces) at neutral or slightly basic condition to form a covalent bond. The hydrophilic PEG spacer arm improves water solubility and provides a long and flexible connection that minimizes steric hindrance involved with ligation. DBCO is commonly used for copper-free Click Chemistry reactions.
[Uses]

Succinimidyl ester (NHS, amine reactive) functionalized cyclooctyne derivative for incorporation of the cyclooctyne moiety into amine containing compounds or biomolecules. Cyclooctynes are useful in strain-promoted copper-free click chemistry cycloaddition reactions. This dibenzocyclooctyne will react with azide functionalized compounds or biomolecules without the need for a Cu(I) catalyst to result in a stable triazole linkage.

Applications Include:
  • Protein-peptide conjugates
  • Antibody-enzyme or antibody-drug conjugates
  • Protein or peptide-oligonucleotide conjugates
  • Surface modification
[reaction suitability]

reaction type: click chemistry
reagent type: linker
[IC 50]

PEGs
Spectrum DetailBack Directory
[Spectrum Detail]

DBCO-PEG4-SE(1427004-19-0)1HNMR
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