BDP 630/650 alkyne

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BDP 630/650 alkyne

BDP 630/650 alkyne | 2006345-38-4

Catalog Number F01-0004
Category BODIPY
Molecular Formula C26H20N3BF2O2S
Molecular Weight 487.33
Catalog Number Size Price Quantity
F01-0004 -- $--

Product Introduction

BDP 630/650 is a red emitting fluorophore matching the Cyanine5 channel. The dye is useful for fluorescence polarization assays. It is also remarkably photostable. The terminal alkyne group can be conjugated with various azides by copper catalyzed Click chemistry.

Chemical Information

Purity NMR 1H, HPLC-MS (95%)
IUPAC Name 2-[4-[(E)-2-(2,2-difluoro-12-thiophen-2-yl-3-aza-1-azonia-2-boranuidatricyclo[7.3.0.03,7]dodeca-1(12),4,6,8,10-pentaen-4-yl)ethenyl]phenoxy]-N-prop-2-ynylacetamide
Canonical SMILES [B-]1(N2C(=CC=C2C=CC3=CC=C(C=C3)OCC(=O)NCC#C)C=C4[N+]1=C(C=C4)C5=CC=CS5)(F)F
InChI InChI=1S/C26H20BF2N3O2S/c1-2-15-30-26(33)18-34-23-12-6-19(7-13-23)5-8-20-9-10-21-17-22-11-14-24(25-4-3-16-35-25)32(22)27(28,29)31(20)21/h1,3-14,16-17H,15,18H2,(H,30,33)/b8-5+
InChI Key DQTUTMHFRQVZSG-VMPITWQZSA-N
Solubility good in DMF, DMSO, alcohols
Appearance dark colored solid
  • Product Specification
ε, L⋅mol-1⋅cm-1 97000
Fluorescence Quantum Yield 0.91
Excitation 628
Emission 642
Storage 24 months after receival at -20°C in the dark. Transportation: at room temperature for up to 3 weeks. Avoid prolonged exposure to light. Desiccate.

Computed Properties

Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 7
Exact Mass 487.1337346 g/mol
Monoisotopic Mass 487.1337346 g/mol
Topological Polar Surface Area 74.5Ų
Heavy Atom Count 35
Formal Charge 0
Complexity 1010
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 1
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes
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