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BDP FL DBCO
| Catalog Number | CCR2093197943 |
| CAS | 2093197-94-3 |
| IUPAC Name | N-[3-(2-Azatricyclo[10.4.0.04,9]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl)-3-oxopropyl]-3-(2,2-difluoro-10,12-dimethyl-1-aza-3-azonia-2-boranuidatricyclo[7.3.0.03,7]dodeca-3,5,7,9,11-pentaen-4-yl)propanamide |
| Molecular Weight | 550.4 |
| Molecular Formula | C32H29BF2N4O2 |
| Canonical SMILES | [B-]1(N2C(=CC(=C2C=C3[N+]1=C(C=C3)CCC(=O)NCCC(=O)N4CC5=CC=CC=C5C#CC6=CC=CC=C64)C)C)(F)F |
| InChI | InChI=1S/C32H29BF2N4O2/c1-22-19-23(2)38-30(22)20-28-14-13-27(39(28)33(38,34)35)15-16-31(40)36-18-17-32(41)37-21-26-9-4-3-7-24(26)11-12-25-8-5-6-10-29(25)37/h3-10,13-14,19-20H,15-18,21H2,1-2H3,(H,36,40) |
| InChI Key | VUFDIEDTPCWBGQ-UHFFFAOYSA-N |
| Purity | 95% |
| Application | SPAAC & SPANC Click Reaction |
| Storage | -20 °C |
| Complexity | 1230 |
| Exact Mass | 550.2351627 |
| Monoisotopic Mass | 550.2351627 |
| Topological Polar Surface Area | 57.4Ų |
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