BDP 630/650 tetrazine

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BDP 630/650 tetrazine

BDP 630/650 tetrazine

Catalog Number R08-0002
Category Tetrazines
Molecular Formula C33H26BF2N7O2S
Molecular Weight 633.5
Catalog Number Size Price Quantity
R08-0002 -- $--

Product Introduction

BDP 630/650 is a borondipyrromethene dye with red emisssion. This fluorophore matches Cyanine5 channel that is often used when minimal background is desired. Tetrazines react with trans-cyclooctenes in an ultra fast reaction called TCO ligation.

Chemical Information

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-[[4-(6-methyl-1,2,4,5-tetrazin-3-yl)phenyl]methyl]acetamide
Canonical SMILES [B-]1(N2C(=CC=C2C=CC3=CC=C(C=C3)OCC(=O)NCC4=CC=C(C=C4)C5=NN=C(N=N5)C)C=C6[N+]1=C(C=C6)C7=CC=CS7)(F)F
InChI InChI=1S/C33H26BF2N7O2S/c1-22-38-40-33(41-39-22)25-9-4-24(5-10-25)20-37-32(44)21-45-29-15-7-23(8-16-29)6-11-26-12-13-27-19-28-14-17-30(31-3-2-18-46-31)43(28)34(35,36)42(26)27/h2-19H,20-21H2,1H3,(H,37,44)/b11-6+
InChI Key CKHJZZWHYDJLEJ-IZZDOVSWSA-N
  • Product Specification
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 10
Rotatable Bond Count 9
Exact Mass 633.1929808 g/mol
Monoisotopic Mass 633.1929808 g/mol
Topological Polar Surface Area 126Ų
Heavy Atom Count 46
Formal Charge 0
Complexity 1230
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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