N-(Azido-PEG2)-N-Fluorescein-PEG4-acid

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N-(Azido-PEG2)-N-Fluorescein-PEG4-acid

N-(Azido-PEG2)-N-Fluorescein-PEG4-acid | 2086689-06-5

Catalog Number R14-0007
Category Azides
Molecular Formula C38H45N5O13S
Molecular Weight 811.9
Catalog Number Size Price Quantity
R14-0007 -- $--

* Please be kindly noted products are not for therapeutic use. We do not sell to patients.

Product Introduction

N-(Azido-PEG2)-N-Fluorescein-PEG4-acid is a fluorescein lableing reagent containing a terminal azide group and a terminal carboxylic acid. The azide group enables PEGylation via Click Chemistry. The terminal carboxylic acid can react with primary amino groups in the presence of EDC or HATU

  • Chemical Information
  • Product Specification
Synonyms 1-azido-9-((3',6'-dihydroxy-3-oxo-3H-spiro[isobenzofuran-1,9'-xanthen]-5-yl)carbamothioyl)-3,6,12,15,18,21-hexaoxa-9-azatetracosan-24-oic acid; 4,7,10,13-Tetraoxa-16-azaheptadecanoic acid, 16-[2-[2-(2-azidoethoxy)ethoxy]ethyl]-17-[(3',6'-dihydroxy-3-oxospiro[isobenzofuran-1(3H),9'-[9H]xanthen]-5-yl)amino]-17-thioxo-
Purity 98%
IUPAC Name 3-[2-[2-[2-[2-[2-[2-(2-azidoethoxy)ethoxy]ethyl-[(3',6'-dihydroxy-3-oxospiro[2-benzofuran-1,9'-xanthene]-5-yl)carbamothioyl]amino]ethoxy]ethoxy]ethoxy]ethoxy]propanoic acid
Canonical SMILES C1=CC2=C(C=C1NC(=S)N(CCOCCOCCN=[N+]=[N-])CCOCCOCCOCCOCCC(=O)O)C(=O)OC23C4=C(C=C(C=C4)O)OC5=C3C=CC(=C5)O
InChI InChI=1S/C38H45N5O13S/c39-42-40-8-12-50-16-17-51-13-9-43(10-14-52-18-20-54-22-21-53-19-15-49-11-7-35(46)47)37(57)41-26-1-4-30-29(23-26)36(48)56-38(30)31-5-2-27(44)24-33(31)55-34-25-28(45)3-6-32(34)38/h1-6,23-25,44-45H,7-22H2,(H,41,57)(H,46,47)
InChI Key NJEUQTQEGQWTHD-UHFFFAOYSA-N
Storage -20 °C

Computed Properties

XLogP3 2.7
Hydrogen Bond Donor Count 4
Hydrogen Bond Acceptor Count 16
Rotatable Bond Count 25
Exact Mass 811.27345768 g/mol
Monoisotopic Mass 811.27345768 g/mol
Topological Polar Surface Area 230Ų
Heavy Atom Count 57
Formal Charge 0
Complexity 1290
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

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