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MCULE-9960213815
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 | 138 USD | 95 | 24 working days | Get Quote |
| 5 mg | 138 USD | 95 | 24 working days | Get Quote |
| 10 mg | 138 USD | 95 | 24 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-9960213815.sdf |
| SMILES | MCULE-9960213815.smiles |
| Standard InChI | MCULE-9960213815.inchi |
| InChIKey | MCULE-9960213815.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-886661973 | 95 | As is | in stock |
| P-889965130 | 95 | As is | by synthesis |
| P-894654504 | 95 | As is | by resynthesis (? - ? days) |
| P-903228058 | 95 | As is | 5 g |
| P-851841838 | N/A | As is | by synthesis |
| P-889805273 | 95 | As is | by synthesis |
| P-611149111 | 95 | As is | by synthesis |
| P-492242511 | 95 | As is | in stock |
| P-893779069 | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 529.539 |
| logP | 3.5395 |
| H-bond acceptors | 10 |
| H-bond donors | 1 |
| Rotatable bonds | 5 |
| PSA | 126.76 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 138.8253 |
| Atoms | 61 |
| Rings | 6 |
| Heavy atoms | 37 |
| Hydrogen atoms | 24 |
| Heteroatoms | 12 |
| N/O atoms | 10 |
| 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 | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
