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MCULE-9509965815-1
Structure
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- InChIKey:
- SMILES:
- InChI:
- Formula:
| Amount | Price
 Optimized compound price excluding delivery costs. Please note that automatic quote generation will optimize the total price based on your preferences.
|
Guaranteed purity (%) | Delivery time
Estimated door-to-door delivery time for EU and US customers. It will be refined and optimized during quote generation after the shipping country is specified.
|
|
|---|---|---|---|---|
| 1 mg | 182 USD | 97 | 19 working days | Get Quote |
| 5 mg | 182 USD | 97 | 19 working days | Get Quote |
| 10 mg | 182 USD | 97 | 19 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-9509965815-1.sdf |
| SMILES | MCULE-9509965815-1.smiles |
| Standard InChI | MCULE-9509965815-1.inchi |
| InChIKey | MCULE-9509965815-1.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-874655197 | AK Scientific | Building Blocks | 97 | As is | in stock |
| P-489122575 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-896029155 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-579631442 | LabSeeker, Inc | On demand Catalog | 98 | As is | by resynthesis (? - ? days) |
| P-864075295 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-502331245 | TimTec | Building Block Collection | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 255.270 |
| logP | 1.321 |
| H-bond acceptors | 7 |
| H-bond donors | 3 |
| Rotatable bonds | 7 |
| PSA | 104.31 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 63.4882 |
| Atoms | 35 |
| Rings | 1 |
| Heavy atoms | 18 |
| Hydrogen atoms | 17 |
| Heteroatoms | 7 |
| N/O atoms | 7 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
