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N-[(1R,8S,9s)-Bicyclo[6.1.0]non-4-yn-9-ylmethyloxycarbonyl]-1,8-diamino-3,6-dioxaoctane - for Copper-free Click Chemistry, high purity , CAS No.1263166-93-3

  • for Copper-free Click Chemistry
Item Number
N485487
Grouped product items
SKUSizeAvailabilityPrice Qty
N485487-25mg
25mg
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$371.90
N485487-100mg
100mg
Available within 8-12 weeks(?)
Production requires sourcing of materials. We appreciate your patience and understanding.
$1,256.90

Basic Description

Synonyms(1α,8α,9β)-Bicyclo[6.1.0]non-4-yn-9-ylmethyl N-{2-[2-(2-aminoethoxy)ethoxy]ethyl}carbamate, BCN-amine
Specifications & Purityfor Copper-free Click Chemistry
Storage TempStore at -20°C
Shipped InIce chest + Ice pads
Product Description

Description

Amine functionalized cyclooctyne derivative. Cyclooctynes are useful in strain-promoted copper-free azide-alkyne cycloaddition reactions. This strained cyclooctyne will react with azide functionalized compounds or biomolecules without the need for a copper catalyst to result in a stable triazole linkage.N-[(1R,8S,9s)-Bicyclo[6.1.0]non-4-yn-9-ylmethyloxycarbonyl]-1,8-diamino-3,6-dioxaoctane may be used to functionalize hyaluronic acid with bicyclo[6.1.0]nonyne (BCN) for the development of responsive HA-based physical hydrogels with tunable properties.

AI Insight

Names and Identifiers

IUPAC Name [(1R,8S)-9-bicyclo[6.1.0]non-4-ynyl]methyl N-[2-[2-(2-aminoethoxy)ethoxy]ethyl]carbamate
INCHI InChI=1S/C17H28N2O4/c18-7-9-21-11-12-22-10-8-19-17(20)23-13-16-14-5-3-1-2-4-6-15(14)16/h14-16H,3-13,18H2,(H,19,20)/t14-,15+,16?
InChi Key YZGOWXGENSKDSE-XYPWUTKMSA-N
Canonical SMILES C1CC2C(C2COC(=O)NCCOCCOCCN)CCC#C1
Isomeric SMILES C1C[C@@H]2[C@@H](C2COC(=O)NCCOCCOCCN)CCC#C1
PubChem CID 75412389
Molecular Weight 324.42
Reaxy-Rn 21037724

Certificates(CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:

Chemical and Physical Properties

Flash Point(°C)248 °C
Molecular Weight324.400 g/mol
XLogP31.100
Hydrogen Bond Donor Count2
Hydrogen Bond Acceptor Count5
Rotatable Bond Count11
Exact Mass324.205 Da
Monoisotopic Mass324.205 Da
Topological Polar Surface Area82.800 Ų
Heavy Atom Count23
Formal Charge0
Complexity411.000
Isotope Atom Count0
Defined Atom Stereocenter Count2
Undefined Atom Stereocenter Count0
Defined Bond Stereocenter Count0
Undefined Bond Stereocenter Count0
The total count of all stereochemical bonds0
Covalently-Bonded Unit Count1

Safety and Hazards(GHS)

Reaxy-Rn 21037724

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References

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