JOE azide, 5-isomer

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JOE azide, 5-isomer

JOE azide, 5-isomer

Catelog Number F12-0001
Category JOE
Molecular Formula C26H20N4Cl2O8
Molecular Weight 587.37
Catalog Number Size Price Quantity
F12-0001 -- $--

Product Introduction

JOE is a fluorescent dye with the emission in yellow region of the spectrum. The fluorophore matches channel of HEX dye, another chlorinated fluorescein.JOE dye is often used in qPCR; oligo labeling can be achieved using Click chemistry. This is an azide derivative of JOE for Click chemistry, pure 5-isomer.

Chemical Information

Purity NMR 1H, HPLC-MS (95%)
IUPAC Name N-(3-azidopropyl)-4',5'-dichloro-3',6'-dihydroxy-2',7'-dimethoxy-3-oxospiro[2-benzofuran-1,9'-xanthene]-5-carboxamide
Canonical SMILES COC1=C(C(=C2C(=C1)C3(C4=C(C=C(C=C4)C(=O)NCCCN=[N+]=[N-])C(=O)O3)C5=CC(=C(C(=C5O2)Cl)O)OC)Cl)O
InChI InChI=1S/C26H20Cl2N4O8/c1-37-16-9-14-22(18(27)20(16)33)39-23-15(10-17(38-2)21(34)19(23)28)26(14)13-5-4-11(8-12(13)25(36)40-26)24(35)30-6-3-7-31-32-29/h4-5,8-10,33-34H,3,6-7H2,1-2H3,(H,30,35)
InChI Key HEOCCOHXKKBACD-UHFFFAOYSA-N
Solubility good in DMF, DMSO
Appearance red solid

Product Specification

ε, L⋅mol-1⋅cm-1 75000
Excitation 533
Emission 554
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

XLogP3 5.2
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 10
Rotatable Bond Count 7
Exact Mass 586.0658190 g/mol
Monoisotopic Mass 586.0658190 g/mol
Topological Polar Surface Area 138Ų
Heavy Atom Count 40
Formal Charge 0
Complexity 981
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes

Patents

Publication NumberTitlePriority Date
US-2014024137-A1 Methods and compositions related to nucleic acid binding assays 2012-07-11
US-2014330001-A1 Methods and compositions related to nucleic acid binding assays 2012-07-11
US-2016282357-A1 Methods and compositions related to nucleic acid binding assays 2012-07-11
US-9017943-B2 Methods and compositions related to nucleic acid binding assays 2012-07-11
US-9410186-B2 Methods and compositions related to nucleic acid binding assays 2012-07-11
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