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APN-PEG4-BCN
| Catalog Number | CCR275 |
| IUPAC Name | [(1S,8R)-9-Bicyclo[6.1.0]non-4-ynyl]methyl N-[2-[2-[2-[2-[3-[4-(2-cyanoethynyl)anilino]-3-oxopropoxy]ethoxy]ethoxy]ethoxy]ethyl]carbamate |
| Molecular Weight | 565.7 |
| Molecular Formula | C31H39N3O7 |
| Canonical SMILES | C1CC2C(C2COC(=O)NCCOCCOCCOCCOCCC(=O)NC3=CC=C(C=C3)C#CC#N)CCC#C1 |
| InChI | InChI=1S/C31H39N3O7/c32-14-5-6-25-9-11-26(12-10-25)34-30(35)13-16-37-18-20-39-22-23-40-21-19-38-17-15-33-31(36)41-24-29-27-7-3-1-2-4-8-28(27)29/h9-12,27-29H,3-4,7-8,13,15-24H2,(H,33,36)(H,34,35)/t27-,28+,29? |
| InChI Key | MCBNMMAFMMPZRN-ULJKERAFSA-N |
| Application | SPAAC & SPANC Click Reaction |
| Complexity | 971 |
| Exact Mass | 565.27880059 |
| Isomeric SMILES | C1C[C@@H]2[C@@H](C2COC(=O)NCCOCCOCCOCCOCCC(=O)NC3=CC=C(C=C3)C#CC#N)CCC#C1 |
| Monoisotopic Mass | 565.27880059 |
| Topological Polar Surface Area | 128Ų |
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