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MCULE-1047547589
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 | 100 USD | 98 | 15 working days | Get Quote |
| 5 mg | 100 USD | 98 | 15 working days | Get Quote |
| 10 mg | 100 USD | 98 | 15 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-1047547589.sdf |
| SMILES | MCULE-1047547589.smiles |
| Standard InChI | MCULE-1047547589.inchi |
| InChIKey | MCULE-1047547589.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-886646409 | 98 | As is | in stock |
| P-890165511 | 98 | As is | in stock |
| P-892787525 | 95 | As is | by resynthesis (? - ? days) |
| P-903205849 | 98 | As is | 6 g |
| P-893508667 | 90 | As is | 5 g |
| P-1270384996 | 98 | As is | in stock |
| P-881615790 | N/A | As is | in stock |
| P-888822303 | 98 | As is | 5 g |
| P-1273393140 | 95 | As is | by resynthesis (? - ? days) |
| P-889843175 | 95 | As is | by synthesis |
| P-890243947 | 98 | As is | 4.205 g |
| P-889335509 | 98 | As is | 6 g |
| P-492244830 | 95 | As is | in stock |
| P-854866806 | 95 | As is | by synthesis |
| P-896084772 | N/A | As is | 15.665 g |
| P-906828691 | 98 | As is | by synthesis |
| P-1271664455 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 189.210 |
| logP | 2.1851 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 53.09 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 54.6505 |
| Atoms | 25 |
| Rings | 2 |
| Heavy atoms | 14 |
| Hydrogen atoms | 11 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| 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 |
