Propargyl-PEG9-bromide

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Propargyl-PEG9-bromide

Propargyl-PEG9-bromide | 2055042-83-4

Catalog Number R01-0179
Category Alkynes
Molecular Formula C21H39BrO9
Molecular Weight 515.43
Catalog Number Size Price Quantity
R01-0179 -- $--

Chemical Information

Synonyms Alkyne-PEG9-Br
Purity >98.0%
Shelf Life -20°C 3 years powder; -80°C 2 years in solvent
Canonical SMILES C#CCOCCOCCOCCOCCOCCOCCOCCOCCOCCBr
InChI InChI=1S/C21H39BrO9/c1-2-4-23-6-8-25-10-12-27-14-16-29-18-20-31-21-19-30-17-15-28-13-11-26-9-7-24-5-3-22/h1H,3-21H2
InChI Key LYYKZUOYGAXPAG-UHFFFAOYSA-N
Solubility 10 mm in DMSO
Appearance Solid
  • Product Specification
Storage Store at -20 °C, keep in dry and avoid sunlight.

Computed Properties

XLogP3 -0.2
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 9
Rotatable Bond Count 27
Exact Mass 514.17775 g/mol
Monoisotopic Mass 514.17775 g/mol
Topological Polar Surface Area 83.1Ų
Heavy Atom Count 31
Formal Charge 0
Complexity 379
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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