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MCULE-2966360057
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 | 48 USD | 90 | 22 working days | Get Quote |
| 5 mg | 70 USD | 90 | 22 working days | Get Quote |
| 10 mg | 88 USD | 90 | 22 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-2966360057.sdf |
| SMILES | MCULE-2966360057.smiles |
| Standard InChI | MCULE-2966360057.inchi |
| InChIKey | MCULE-2966360057.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-454678948 | 90 | As is | in stock |
| P-15143107 | 90 | As is | 28 mg |
| P-436441120 | 90 | As is | 8.796 g |
| P-298288 | 90 | As is | 894 mg |
| P-34717071 | 90 | As is | by synthesis |
| P-580786402 | 90 | As is | by resynthesis (? - ? days) |
| P-869016766 | 95 | As is | by synthesis |
| P-491224674 | 95 | As is | by synthesis |
| P-24058909 | 90 | As is | in stock |
| P-22615253 | 90 | As is | in stock |
| P-502336001 | 90 | As is | in stock |
| P-2373543 | 90 | As is | 138 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 198.219 |
| logP | 1.1824 |
| H-bond acceptors | 5 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 67.43 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 58.0964 |
| Atoms | 28 |
| Rings | 1 |
| Heavy atoms | 14 |
| Hydrogen atoms | 14 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| 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 |
