Cyanine3 alkyne

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Cyanine3 alkyne

Cyanine3 alkyne

Catalog Number R02-0021
Category Alkynes
Molecular Formula C33H40ClN3O
Molecular Weight 530.14
Catalog Number Size Price Quantity
R02-0021 -- $--

Product Introduction

Cyanine3 alkyne is a fluorophore ready for the use in Click Chemistry reaction.With this reagent, bright and photostable Cyanine3 reporter, an analog of Cy3®, can be attached to nearly any molecule bearing azide group.

Chemical Information

Related CAS 1902918-31-3 (without anion)
Purity NMR 1H (95%), HPLC-MS
IUPAC Name 6-[3,3-dimethyl-2-[3-(1,3,3-trimethylindol-1-ium-2-yl)prop-2-enylidene]indol-1-yl]-N-prop-2-ynylhexanamide;chloride
Canonical SMILES CC1(C2=CC=CC=C2[N+](=C1C=CC=C3C(C4=CC=CC=C4N3CCCCCC(=O)NCC#C)(C)C)C)C.[Cl-]
InChI InChI=1S/C33H39N3O.ClH/c1-7-23-34-31(37)22-9-8-14-24-36-28-19-13-11-17-26(28)33(4,5)30(36)21-15-20-29-32(2,3)25-16-10-12-18-27(25)35(29)6;/h1,10-13,15-21H,8-9,14,22-24H2,2-6H3;1H
InChI Key YIXIKYACJGHYQL-UHFFFAOYSA-N
Solubility soluble in organic solvents (DMF, DMSO, dichloromethane), , practically insoluble in water (50 mg/L = 80 uM)
Appearance red powder
  • Product Specification
ε, L⋅mol-1⋅cm-1 150000
Fluorescence Quantum Yield 0.31
Excitation 555
Emission 570
Storage 24 months after receival at -20°C in the dark. Transportation: at room temperature for up to 3 weeks.

Computed Properties

Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 9
Exact Mass 529.2859906 g/mol
Monoisotopic Mass 529.2859906 g/mol
Topological Polar Surface Area 35.4Ų
Heavy Atom Count 38
Formal Charge 0
Complexity 975
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 2
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes
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