N-(m-PEG4)-N'-(hydroxy-PEG2)-Cy5

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N-(m-PEG4)-N'-(hydroxy-PEG2)-Cy5

N-(m-PEG4)-N'-(hydroxy-PEG2)-Cy5 | CAS 2107273-12-9

Catalog Number A17-0138
Category Cyanine5
Molecular Formula C40H57ClN2O7
Molecular Weight 713.4
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Product Introduction

N-(m-PEG4)-N'-(hydroxy-PEG2)-Cy5 is a cyanine labeled PEG linker with excitation/emmission maximum 649/667 nm containing hydroxyl group, which enables further derivatized or replaced with other reactive functional groups. Hydophilic PEG spacer increases solubility in aqueous media and reduces steric hindrance during binding.

  • Chemical Information

  • Product Specification

  • Application

  • Computed Properties

  • Patents

Synonyms 2-[(1E,3E)-5-[(2E)-3,3-dimethyl-1-(2,5,8,11-tetraoxatridecan-13-yl)-2,3-dihydro-1H-indol-2-ylidene]penta-1,3-dien-1-yl]-1-{2-[2-(2-hydroxyethoxy)ethoxy]ethyl}-3,3-dimethyl-3H-indol-1-ium chloride
Purity 97%
IUPAC Name 2-[2-[2-[2-[(1E,3E,5E)-5-[1-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]-3,3-dimethylindol-2-ylidene]penta-1,3-dienyl]-3,3-dimethylindol-1-ium-1-yl]ethoxy]ethoxy]ethanol;chloride
Canonical SMILES CC1(C2=CC=CC=C2[N+](=C1C=CC=CC=C3C(C4=CC=CC=C4N3CCOCCOCCOCCOC)(C)C)CCOCCOCCO)C.[Cl-]
InChI InChI=1S/C40H57N2O7.ClH/c1-39(2)33-13-9-11-15-35(33)41(19-22-45-27-29-47-24-21-43)37(39)17-7-6-8-18-38-40(3,4)34-14-10-12-16-36(34)42(38)20-23-46-28-30-49-32-31-48-26-25-44-5;/h6-18,43H,19-32H2,1-5H3;1H/q+1;/p-1
InChIKey IZJBQJRLNJOCMH-UHFFFAOYSA-M
Solubility Water, DMSO, DMF, DCM
Excitation 650
Emission 691
Storage -20 °C
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 23
Exact Mass 712.3854299 g/mol
Monoisotopic Mass 712.3854299 g/mol
Topological Polar Surface Area 81.9Ų
Heavy Atom Count 50
Formal Charge 0
Complexity 1080
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 3
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes
Publication Number Title Priority Date
US-2017197916-A1 Functionalized pegylated cyanine compounds, pharmaceutical compositions, and methods of use thereof 2016-01-08
US-9862682-B2 Functionalized pegylated cyanine compounds, pharmaceutical compositions, and methods of use thereof 2016-01-08

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