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rel-((1R,8S,9r)-Bicyclo[6.1.0]non-4-yn-9-yl)methyl (2,5-dioxopyrrolidin-1-yl) carbonate
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rel-((1R,8S,9r)-Bicyclo[6.1.0]non-4-yn-9-yl)methyl (2,5-dioxopyrrolidin-1-yl) carbonate

Catalog NumberCCR1426827793
CAS1426827-79-3
IUPAC Name[(1S,8R)-9-Bicyclo[6.1.0]non-4-ynyl]methyl (2,5-dioxopyrrolidin-1-yl) carbonate
Molecular Weight291.30
Molecular FormulaC15H17NO5
Canonical SMILESC1CC2C(C2COC(=O)ON3C(=O)CCC3=O)CCC#C1
InChIInChI=1S/C15H17NO5/c17-13-7-8-14(18)16(13)21-15(19)20-9-12-10-5-3-1-2-4-6-11(10)12/h10-12H,3-9H2/t10-,11+,12?
InChI KeySKTDJYHCSCYLQU-FOSCPWQOSA-N
Boiling Point412.8±28.0 °C(Predicted)
Purity98%
Density1.35±0.1 g/cm3(Predicted)
ApplicationSPAAC & SPANC Click Reaction
Storage-20 °C
Complexity509
Exact Mass291.11067264
Isomeric SMILESC1C[C@@H]2[C@@H](C2COC(=O)ON3C(=O)CCC3=O)CCC#C1
Monoisotopic Mass291.11067264
Topological Polar Surface Area72.9Ų

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