DBCO-PEG9-amine
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Product Code | F987121 |
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Product Name | DBCO-PEG9-amine |
CAS | 2353409-99-9 |
Molecular weight | 743.895 |
IUPAC Name | N-(29-amino-3,6,9,12,15,18,21,24,27-nonaoxanonacosan-1-yl)-4-{2-azatricyclo[10.4.0.0⁴,⁹]hexadeca-1(16),4,6,8,12,14-hexaen-10-yn-2-yl}-4-oxobutanamide |
SMILES | NCCOCCOCCOCCOCCOCCOCCOCCOCCOCCNC(=O)CCC(=O)N1CC2=CC=CC=C2C#CC2=CC=CC=C12 |
INCHI Code | InChI=1S/C39H57N3O11/c40-13-15-45-17-19-47-21-23-49-25-27-51-29-31-53-32-30-52-28-26-50-24-22-48-20-18-46-16-14-41-38(43)11-12-39(44)42-33-36-7-2-1-5-34(36)9-10-35-6-3-4-8-37(35)42/h1-8H,11-33,40H2,(H,41,43) |
Asymmetric atoms | 0 |
LogP | 0.96915174 |
H bond acceptors | 12 |
H bond donors | 2 |
fsp3 | 0.5897436 |
Concept Codes | Alkyne, Terminal alkyne, Ether, Heterocycle, Amide, Primary amine, Amine (P+S+T), Terminal alkyne (aliphatic hydrocarbon), Terminal alkyne (aromatic hydrocarbon), Cyclic, Aromatic, PEG-2 |