Rocuronium Bromide
- CAS:
- Other names:
- SMILES: [Br-].CC(=O)O[C@H]1[C@H](C[C@H]2[C@@H]3CC[C@H]4C[C@H](O)[C@H](C[C@]4(C)[C@H]3CC[C@]12C)N5CCOCC5)[N+]6(CCCC6)CC=C
Properties
| MW | HBA | HBD | LogP | TPSA | Rot. | Comp. | Fsp3C | Brutto formula |
|---|---|---|---|---|---|---|---|---|
| 609.68 | 5 | 1 | 1.31 | 59.0 | 6 | 67 | 0.91 | C32H53BrN2O4 |
Availability
| Suppliers | Supplier IDs | Storage | Storage ID | Quantity | Class | Added |
|---|---|---|---|---|---|---|
| SF_C1677 | None | Jan. 1, 2023 |
Bar codes
| Plate barcode | Sample barcode |
|---|---|
PAINS
| Identified PAINS |
|---|
| Not checked |
Supramolecules
| Name | log K | SD | pH | T(°C) | Method | Ref |
|---|---|---|---|---|---|---|
| [b-Cyclodextrin](1).[Rocuronium Bromide] | 3.52 | 2.70 | 30.0 | NMR spectroscopy | Lee Fielding 2002 | |
| [g-Cyclodextrin](1).[Rocuronium Bromide] | 4.26 | 3.30 | 30.0 | NMR spectroscopy | Lee Fielding 2002 | |