BDP 630/650 carboxylic acid

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BDP 630/650 carboxylic acid

BDP 630/650 carboxylic acid | 2183512-02-7

Catelog Number F01-0007
Category BODIPY
Molecular Formula C23H17N2BF2O3S
Molecular Weight 450.27
Catalog Number Size Price Quantity
F01-0007 -- $--

Product Introduction

BDP 630/650 is a bright far red fluorophore based on borondipyrromethene scaffold. This is a carboxylic acid derivative that can be activated for the coupling with amines. It can also be used as a control in negative experiments, or when chemical attachment of the dye is not necessary.

Chemical Information

Synonyms BDP630/650carboxylicacid
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]acetic acid
Canonical SMILES [B-]1(N2C(=CC=C2C=CC3=CC=C(C=C3)OCC(=O)O)C=C4[N+]1=C(C=C4)C5=CC=CS5)(F)F
InChI InChI=1S/C23H17BF2N2O3S/c25-24(26)27-17(6-3-16-4-10-20(11-5-16)31-15-23(29)30)7-8-18(27)14-19-9-12-21(28(19)24)22-2-1-13-32-22/h1-14H,15H2,(H,29,30)/b6-3+
InChI Key NPYDYOGYLPDKRP-ZZXKWVIFSA-N
Solubility good in DMF, DMSO
Appearance dark powder

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 7
Rotatable Bond Count 6
Exact Mass 450.1021001 g/mol
Monoisotopic Mass 450.1021001 g/mol
Topological Polar Surface Area 82.7Ų
Heavy Atom Count 32
Formal Charge 0
Complexity 883
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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