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MCULE-9442973547
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 | 5 USD | 98 | 14 working days | Get Quote |
| 5 mg | 5 USD | 98 | 14 working days | Get Quote |
| 10 mg | 5 USD | 98 | 14 working days | Get Quote |
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MCULE-5541612570
- Component type: Unknown
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MCULE-1451632921
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-9442973547.sdf |
| SMILES | MCULE-9442973547.smiles |
| Standard InChI | MCULE-9442973547.inchi |
| InChIKey | MCULE-9442973547.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-903058939 | 98 | As is | 2 kg |
| P-905480200 | 98 | As is | 100 g |
| P-893553804 | 90 | As is | 20.0926 kg |
| P-489114217 | 97 | As is | in stock |
| P-895915615 | 95 | As is | by resynthesis (? - ? days) |
| P-494305657 | 95 | As is | 406.6 g |
| P-860055908 | 98 | As is | by synthesis |
| P-666960743 | 98 | As is | 1.217 kg |
| P-590926797 | 95 | As is | by synthesis |
| P-851268410 | 95 | As is | by synthesis |
| P-868644865 | 98 | As is | in stock |
| P-500245851 | N/A | As is | in stock |
| P-905361422 | 98 | As is | 6.7883 kg |
| P-493678969 | N/A | As is | in stock |
| P-579616767 | 98 | As is | unavailable |
| P-852443495 | N/A | As is | in stock |
| P-895895122 | 95 | As is | in stock |
| P-854692256 | 95 | As is | in stock |
| P-1263958205 | 90 | As is | in stock |
| P-1263955805 | 90 | As is | in stock |
| P-579711458 | N/A | As is | in stock |
| P-895200189 | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 244.313 |
| logP | 1.4544 |
| H-bond acceptors | 5 |
| H-bond donors | 3 |
| Rotatable bonds | 5 |
| PSA | 103.73 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 69.3412 |
| Atoms | 32 |
| Rings | 2 |
| Heavy atoms | 16 |
| Hydrogen atoms | 16 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 3 |
| R/S chiral centers | 3 |
| 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 |
