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MCULE-2885245608-0
Structure
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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 | 7 USD | 98 | 14 working days | Get Quote |
| 5 mg | 7 USD | 98 | 14 working days | Get Quote |
| 10 mg | 7 USD | 98 | 14 working days | Get Quote |
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MCULE-7857189389-1
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-2885245608-0.sdf |
| SMILES | MCULE-2885245608-0.smiles |
| Standard InChI | MCULE-2885245608-0.inchi |
| InChIKey | MCULE-2885245608-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-1270248087 | N/A | As is | in stock |
| P-1274693184 | N/A | As is | by synthesis |
| P-903205200 | 98 | As is | 2.5 kg |
| P-1273178129 | N/A | As is | 50 g |
| P-1264048498 | 95 | As is | in stock |
| P-871220404 | N/A | As is | by resynthesis (? - ? days) |
| P-500417275 | N/A | As is | in stock |
| P-870661999 | 98 | As is | in stock |
| P-505494020 | 95 | As is | in stock |
| P-488555745 | 92 | As is | in stock |
| P-519992723 | 90 | As is | in stock |
| P-869108088 | 95 | As is | 1.001 g |
| P-888627131 | 95 | As is | 1.001 g |
| P-596713720 | 90 | As is | 9 mg |
| P-1605395 | 90 | As is | 57 mg |
| P-505494221 | 95 | As a main component | in stock |
| P-611421063 | 90 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 252.342 |
| logP | 1.37918 |
| H-bond acceptors | 6 |
| H-bond donors | 3 |
| Rotatable bonds | 7 |
| PSA | 114.19 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 69.1831 |
| Atoms | 33 |
| Rings | 1 |
| Heavy atoms | 17 |
| Hydrogen atoms | 16 |
| Heteroatoms | 7 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 1 |
| Cis/trans stereo double bonds | 1 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
