Azido-PEG4-Amido-tri-(t-butoxycarbonylethoxymethyl)-methane

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Azido-PEG4-Amido-tri-(t-butoxycarbonylethoxymethyl)-methane

Azido-PEG4-Amido-tri-(t-butoxycarbonylethoxymethyl)-methane | 1421933-29-0

Catelog Number R14-0041
Category Azides
Molecular Formula C36H66N4O14
Molecular Weight 778.94
Catalog Number Size Price Quantity
R14-0041 -- $--

Product Introduction

Azido-PEG4-Amido-tri-(t-butoxycarbonylethoxymethyl)-methane is a branched PEG derivative with a terminal azide group and three t-butyl esters. The azide group enables PEGylation via Click Chemistry. The t-butyl protected carboxyl groups can be deprotected under mild acidic conditions.

Chemical Information

Synonyms tert-butyl 1-azido-17,17-bis((3-(tert-butoxy)-3-oxopropoxy)methyl)-15-oxo-3,6,9,12,19-pentaoxa-16-azadocosan-22-oate; 3-[2-[3-(2-(2-[2-(2-Azido-ethoxy)-ethoxy]-ethoxy)-ethoxy)-propionylamino]-3-(2-tert-butoxycarbonyl-ethoxy)-2-(2-tert-butoxycarbonyl-ethoxymethyl)-propoxy]-propionic acid tert-butyl ester; 2-Methyl-2-propanyl 1-azido-17,17-bis({3-[(2-methyl-2-propanyl)oxy]-3-oxopropoxy}methyl)-15-oxo-3,6,9,12,19-pentaoxa-16-azadocosan-22-oate; 3,6,9,12,19-Pentaoxa-16-azadocosan-22-oic acid, 1-azido-17,17-bis[[3-(1,1-dimethylethoxy)-3-oxopropoxy]methyl]-15-oxo-, 1,1-dimethylethyl ester; WUN 33290; WUN-33290; WUN33290
Purity ≥95%
IUPAC Name tert-butyl 3-[2-[3-[2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethoxy]propanoylamino]-3-[3-[(2-methylpropan-2-yl)oxy]-3-oxopropoxy]-2-[[3-[(2-methylpropan-2-yl)oxy]-3-oxopropoxy]methyl]propoxy]propanoate
Canonical SMILES CC(C)(C)OC(=O)CCOCC(COCCC(=O)OC(C)(C)C)(COCCC(=O)OC(C)(C)C)NC(=O)CCOCCOCCOCCOCCN=[N+]=[N-]
InChI InChI=1S/C36H66N4O14/c1-33(2,3)52-30(42)11-16-49-26-36(27-50-17-12-31(43)53-34(4,5)6,28-51-18-13-32(44)54-35(7,8)9)39-29(41)10-15-45-20-22-47-24-25-48-23-21-46-19-14-38-40-37/h10-28H2,1-9H3,(H,39,41)
InChI Key WXDPDERWOTZNLB-UHFFFAOYSA-N
Solubility Soluble in DMSO
Appearance Yellowish Oily Matter

Product Specification

Storage Store at 2-8°C for short term (days to weeks) or -20°C for long term (months to years)

Computed Properties

XLogP3 1.7
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 16
Rotatable Bond Count 37
Exact Mass 778.45755279 g/mol
Monoisotopic Mass 778.45755279 g/mol
Topological Polar Surface Area 187Ų
Heavy Atom Count 54
Formal Charge 0
Complexity 1020
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

Patents

Publication NumberTitlePriority Date
WO-2022265493-A1 Conjugate of saponin, oligonucleotide and galnac 2021-06-18
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