BDP 581/591 hydrazide

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BDP 581/591 hydrazide

BDP 581/591 hydrazide

Catalog Number R05-0002
Category BODIPY
Molecular Formula C22H22N4BClF2O
Molecular Weight 442.7
Catalog Number Size Price Quantity
R05-0002 -- $--

Product Introduction

BDP 581/591 hydrazide is a carbonyl reactive dye. BDP 581/591 is a borondipyrromethene fluorophore with bright emission, and oustanding photostability.Aldehyde and ketone groups that can be labeled can be obtained by oxidation of 1,2-diol groups in sugars; they are also present in proteins after oxidative stress, and in many small molecules.

Chemical Information

Related CAS 2183473-40-5 (hydrochloride) 2183473-39-2 (inner salt)
Purity NMR 1H, HPLC-MS (95%)
IUPAC Name [3-[2,2-difluoro-12-[(1E,3E)-4-phenylbuta-1,3-dienyl]-3-aza-1-azonia-2-boranuidatricyclo[7.3.0.03,7]dodeca-1(12),4,6,8,10-pentaen-4-yl]propanoylamino]azanium;chloride
Canonical SMILES [B-]1(N2C(=CC=C2CCC(=O)N[NH3+])C=C3[N+]1=C(C=C3)C=CC=CC4=CC=CC=C4)(F)F.[Cl-]
InChI InChI=1S/C22H21BF2N4O.ClH/c24-23(25)28-18(9-5-4-8-17-6-2-1-3-7-17)10-12-20(28)16-21-13-11-19(29(21)23)14-15-22(30)27-26;/h1-13,16H,14-15,26H2,(H,27,30);1H/b8-4+,9-5+;
InChI Key YBNBSHNGIGNNNW-VYMJFYGFSA-N
Solubility good in DMF, DMSO, alcohols
Appearance dark colored solid
  • Product Specification
ε, L⋅mol-1⋅cm-1 104000
Fluorescence Quantum Yield 0.83
Excitation 585
Emission 594
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 2
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 6
Exact Mass 442.1543255 g/mol
Monoisotopic Mass 442.1543255 g/mol
Topological Polar Surface Area 64.7Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 827
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 2
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 2
Compound Is Canonicalized Yes
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