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MCULE-6687995452
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 | 10 USD | 97 | 14 working days | Get Quote |
| 5 mg | 10 USD | 97 | 14 working days | Get Quote |
| 10 mg | 10 USD | 97 | 14 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-6687995452.sdf |
| SMILES | MCULE-6687995452.smiles |
| Standard InChI | MCULE-6687995452.inchi |
| InChIKey | MCULE-6687995452.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867292378 | 97 | As is | by synthesis |
| P-901185626 | N/A | As is | by synthesis |
| P-894611676 | 95 | As is | in stock |
| P-903050476 | 97 | As is | 1000 mg |
| P-893555247 | 90 | As is | 100 mg |
| P-851426497 | N/A | As is | by synthesis |
| P-489113308 | 97 | As is | in stock |
| P-597007329 | 97 | As is | unavailable |
| P-895922037 | 95 | As is | by resynthesis (? - ? days) |
| P-905440470 | 95 | As is | by synthesis |
| P-608392207 | 97 | As is | by synthesis |
| P-887328590 | 95 | As is | by synthesis |
| P-596565731 | 95 | As is | 1000 mg |
| P-31258431 | 90 | As is | unavailable |
| P-580490286 | N/A | As is | by synthesis |
| P-854737378 | 95 | As is | in stock |
| P-500398716 | 95 | As is | by synthesis |
| P-535692004 | N/A | As is | in stock |
| P-906863291 | 97 | As is | by synthesis |
| P-615417040 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 196.311 |
| logP | 3.9012 |
| H-bond acceptors | 1 |
| H-bond donors | 0 |
| Rotatable bonds | 6 |
| PSA | 45.31 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 58.5485 |
| Atoms | 29 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 16 |
| Heteroatoms | 2 |
| N/O atoms | 1 |
| 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 | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
