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MCULE-9401524875-1
Structure
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- 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 | 36 USD | 95 | 15 working days | Get Quote |
| 5 mg | 58 USD | 90 | 22 working days | Get Quote |
| 10 mg | 73 USD | 90 | 22 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-9401524875-1.sdf |
| SMILES | MCULE-9401524875-1.smiles |
| Standard InChI | MCULE-9401524875-1.inchi |
| InChIKey | MCULE-9401524875-1.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-852178240 | N/A | As an isomer | by synthesis |
| P-577201311 | 90 | As an isomer | 87 mg |
| P-612674499 | 90 | As an isomer | in stock |
| P-502676366 | 90 | As an isomer | in stock |
| P-13063194 | 95 | As an isomer | 244 mg |
| P-596586555 | 90 | As an isomer | 5 g |
| P-893278406 | 95 | As an isomer | by resynthesis (? - ? days) |
| P-35183930 | 90 | As an isomer | 10.246 kg |
| P-864023084 | 95 | As an isomer | by synthesis |
| P-885522894 | 95 | As an isomer | by synthesis |
| P-18978837 | 90 | As an isomer | in stock |
| P-33838125 | 90 | As an isomer | in stock |
| P-903955341 | 94 | As an isomer | by resynthesis (? - ? days) |
| P-640576 | 90 | As an isomer | 1.389 g |
| P-3219272 | 90 | As an isomer | 1.389 g |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 211.650 |
| logP | 2.5334 |
| H-bond acceptors | 5 |
| H-bond donors | 5 |
| Rotatable bonds | 4 |
| PSA | 97.78 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 58.2552 |
| Atoms | 24 |
| Rings | 1 |
| Heavy atoms | 14 |
| Hydrogen atoms | 10 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 2 |
| Cis/trans stereo double bonds | 2 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
