Fluorescein-DBCO

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Fluorescein-DBCO

Fluorescein-DBCO | CAS 2054339-00-1

Catalog Number F04-0008
Category Fluorescein FAM
Molecular Formula C39H27N3O6S
Molecular Weight 665.71
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Product Introduction

  • Chemical Information

  • Product Specification

  • Application

  • Computed Properties

Synonyms DBCO-FITC(5-isomer)
Purity >98.0%
Shelf Life 0-4°C for short term (days to weeks), or -20°C for long term (months).
IUPAC Name
Canonical SMILES C1C2=CC=CC=C2C#CC3=CC=CC=C3N1C(=O)CCNC(=S)NC4=CC5=C(C=C4)C6(C7=C(C=C(C=C7)O)OC8=C6C=CC(=C8)O)OC5=O
InChI InChI=1S/C39H27N3O6S/c43-27-12-15-31-34(20-27)47-35-21-28(44)13-16-32(35)39(31)30-14-11-26(19-29(30)37(46)48-39)41-38(49)40-18-17-36(45)42-22-25-7-2-1-5-23(25)9-10-24-6-3-4-8-33(24)42/h1-8,11-16,19-21,43-44H,17-18,22H2,(H2,40,41,49)
InChIKey FGEDVMJBPDYXLU-UHFFFAOYSA-N
Solubility 10 mm in DMSO
Appearance Solid
Excitation 494
Emission 517
Storage Store at -5°C,keep in dry and avoid sunlight.
XLogP3 5.6
Hydrogen Bond Donor Count 4
Hydrogen Bond Acceptor Count 7
Rotatable Bond Count 4
Exact Mass 665.16205676 g/mol
Monoisotopic Mass 665.16205676 g/mol
Topological Polar Surface Area 152Ų
Heavy Atom Count 49
Formal Charge 0
Complexity 1320
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

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