N-methyl-N'-methyl-O-(m-PEG4)-O'-(acid-PEG5)-Cy5

Catelog Number	A17-0171
Category	Cyanine5
Molecular Formula	C49H73ClN2O13
Molecular Weight	933.6

Catalog Number	Size	Price	Quantity
A17-0171	--	$--

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Product Introduction

N-methyl-N'-methyl-O-(m-PEG4)-O'-(acid-PEG5)-Cy5 is a PEG linker containing a cyanine dye with excitation/emmission maximum 649/667 nm and a free terminal carboxyl acid. Terminal carboxylic acid can react with primary amine groups in the presence of of activators (e.g. EDC, or HATU) to form a stable amide bond. The hydophilic PEG spacer increases solubility in aqueous media. Please contact us for GMP-grade inquiries.

Chemical Information
Purity	0.98
IUPAC Name	3-[2-[2-[2-[2-[2-[(2E)-2-[(2E,4E)-5-[5-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]-1,3,3-trimethylindol-1-ium-2-yl]penta-2,4-dienylidene]-1,3,3-trimethylindol-5-yl]oxyethoxy]ethoxy]ethoxy]ethoxy]ethoxy]propanoic acid;chloride
Canonical SMILES	CC1(C2=C(C=CC(=C2)OCCOCCOCCOCCOC)[N+](=C1C=CC=CC=C3C(C4=C(N3C)C=CC(=C4)OCCOCCOCCOCCOCCOCCC(=O)O)(C)C)C)C.[Cl-]
InChI	InChI=1S/C49H72N2O13.ClH/c1-48(2)41-37-39(63-35-33-61-31-29-58-24-23-56-20-19-54-7)13-15-43(41)50(5)45(48)11-9-8-10-12-46-49(3,4)42-38-40(14-16-44(42)51(46)6)64-36-34-62-32-30-60-28-27-59-26-25-57-22-21-55-18-17-47(52)53;/h8-16,37-38H,17-36H2,1-7H3;1H
InChI Key	IVWOCBLGGSXMPC-UHFFFAOYSA-N
Solubility	Water, DMSO, DMF, DCM

Product Specification
Excitation	649
Emission	667
Storage	-20°C

Computed Properties
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	15
Rotatable Bond Count	35
Exact Mass	932.4801181 g/mol
Monoisotopic Mass	932.4801181 g/mol
Topological Polar Surface Area	145Å²
Heavy Atom Count	65
Formal Charge	0
Complexity	1430
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