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MCULE-2058033578
Compound
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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 | 9 USD | 97 | 19 working days | Get Quote |
| 5 mg | 9 USD | 97 | 19 working days | Get Quote |
| 10 mg | 9 USD | 97 | 19 working days | Get Quote |
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MCULE-9488093105
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-2058033578.sdf |
| SMILES | MCULE-2058033578.smiles |
| Standard InChI | MCULE-2058033578.inchi |
| InChIKey | MCULE-2058033578.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-903010913 | 95 | As is | 750 mg |
| P-617043414 | 95 | As is | by resynthesis (? - ? days) |
| P-489166334 | 97 | As is | in stock |
| P-617432467 | 95 | As is | 1.045 g |
| P-591012526 | 97 | As is | by synthesis |
| P-851279110 | 95 | As is | by synthesis |
| P-861550605 | 97 | As is | by synthesis |
| P-893621221 | 95 | As is | in stock |
| P-852605408 | N/A | As is | in stock |
| P-903019277 | 97 | As a main component | 10 g |
| P-893511079 | 90 | As a main component | 37.447 g |
| P-590935505 | 97 | As a main component | by synthesis |
| P-887965711 | 97 | As a main component | in stock |
| P-889287966 | 97 | As a main component | 16.097 g |
| P-854750079 | 95 | As a main component | in stock |
| P-893134106 | N/A | As an isomer | by synthesis |
| P-867512726 | N/A | As an isomer | by synthesis |
| P-588713989 | 95 | As an isomer | 1000 mg |
| P-524196876 | 95 | As an isomer | 10 g |
| P-889870377 | 95 | As an isomer | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 127.141 |
| logP | 0.6747 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 1 |
| PSA | 63.32 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 32.8472 |
| Atoms | 18 |
| Rings | 1 |
| Heavy atoms | 9 |
| Hydrogen atoms | 9 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 2 |
| R/S chiral centers | 2 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
