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6-TET Azide

CAT: 0804-HY-D1898Size: 1 EachDry Ice: NoHazardous: No
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Description
6-TET Azide is a fluorescent probe that can be used for the preparation of fluorescent contrast agent and nucleic acid sequencing[1].
CAS Number
1450752-90-5
UNSPSC
12171500
Target
Fluorescent Dye
Type
Dye Reagents
Related Pathways
Others
Field of Research
Others
Assay Protocol
https://www.medchemexpress.com/6-tet-azide.html
Solubility
10 mM in DMSO
Smiles
[N-]=[N+]=NCCCNC(C1=CC(Cl)=C2C(OC3(C2=C1Cl)C4=CC(Cl)=C(C=C4OC5=CC(O)=C(C=C53)Cl)O)=O)=O
Molecular Formula
C24H14Cl4N4O6
Molecular Weight
596.20
References & Citations
[1]Lintao Cai, et al. Fluorescence contrast agent and preparation method thereof. Patent CN103239737A.
Shipping Conditions
Room temperature
Scientific Category
Dye Reagents
Clinical Information
No Development Reported

Chemical Information

TET azide, 6-isomer
CAS Number1450752-90-5
PubChem CID99940838
IUPAC NameN-(3-azidopropyl)-2',4,7,7'-tetrachloro-3',6'-dihydroxy-1-oxospiro[2-benzofuran-3,9'-xanthene]-5-carboxamide
Molecular FormulaC24H14Cl4N4O6
Molecular Weight596.2
XLogP6.5
Topological Polar Surface Area119
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count8
Rotatable Bond Count5
Heavy Atom Count38
Formal Charge0
Complexity958
SMILES
C1=C(C(=C2C(=C1Cl)C(=O)OC23C4=CC(=C(C=C4OC5=CC(=C(C=C35)Cl)O)O)Cl)Cl)C(=O)NCCCN=[N+]=[N-]
InChI
InChI=1S/C24H14Cl4N4O6/c25-12-5-10-17(7-15(12)33)37-18-8-16(34)13(26)6-11(18)24(10)20-19(23(36)38-24)14(27)4-9(21(20)28)22(35)30-2-1-3-31-32-29/h4-8,33-34H,1-3H2,(H,30,35)
InChIKey
SYCHFKJSIPYARI-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of TET azide, 6-isomer
CAS: 1450752-90-5
CID: 99940838
Formula: C24H14Cl4N4O6
MW: 596.2
Interactive 3D Structure
Loading 3D structure...
View on PubChemRaw 3D data
Computed Properties
PropertyValue
Molecular Weight596.2
XLogP36.5
Hydrogen Bond Donor Count3
Hydrogen Bond Acceptor Count8
Rotatable Bond Count5
Exact Mass595.963795
Monoisotopic Mass593.966745
Topological Polar Surface Area119 Ų
Heavy Atom Count38
Formal Charge0
Complexity958
Isotope Atom Count0
Defined Atom Stereocenter Count0
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
Covalently-Bonded Unit Count1
Compound Is CanonicalizedYes

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