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Azido-PEG3-phosphonic acid

CAT: 0804-HY-140812Size: 1 EachDry Ice: NoHazardous: No
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Description
Azido-PEG3-phosphonic acid is a PEG linker which contains an azide moiety and a phosphonic acid. Azido-PEG3-phosphonic acid is a click chemistry reagent. It contains an azide group and can undergo copper-catalyzed azide-alkyne cycloaddition (CuAAc) with molecules containing alkyne groups.
CAS Number
1964503-38-5
UNSPSC
12352211
Target
Biochemical Assay Reagents
Related Pathways
Others
Field of Research
Others
Smiles
OP(O)(CCOCCOCCOCCN=[N+]=[N-])=O
Molecular Formula
C8H18N3O6P
Molecular Weight
283.22
Shipping Conditions
Room temperature
Scientific Category
Reference compound1
Clinical Information
No Development Reported

Chemical Information

Azido-PEG3-phosphonic acid
CAS Number1964503-38-5
PubChem CID123132154
IUPAC Name2-[2-[2-(2-azidoethoxy)ethoxy]ethoxy]ethylphosphonic acid
Molecular FormulaC8H18N3O6P
Molecular Weight283.22
XLogP-1.1
Topological Polar Surface Area99.6
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count12
Heavy Atom Count18
Formal Charge0
Complexity291
SMILES
C(COCCOCCOCCP(=O)(O)O)N=[N+]=[N-]
InChI
InChI=1S/C8H18N3O6P/c9-11-10-1-2-15-3-4-16-5-6-17-7-8-18(12,13)14/h1-8H2,(H2,12,13,14)
InChIKey
ZSTIPXPOWKYOBR-UHFFFAOYSA-N
Chemical Structure
2D Structure
2D structure of Azido-PEG3-phosphonic acid
CAS: 1964503-38-5
CID: 123132154
Formula: C8H18N3O6P
MW: 283.22
Interactive 3D Structure
Loading 3D structure...
Computed Properties
PropertyValue
Molecular Weight283.22
XLogP3-1.1
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count8
Rotatable Bond Count12
Exact Mass283.09332230
Monoisotopic Mass283.09332230
Topological Polar Surface Area99.6 Ų
Heavy Atom Count18
Formal Charge0
Complexity291
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