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MCULE-4169114912
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 | 91 USD | 95 | 24 working days | Get Quote |
| 5 mg | 91 USD | 95 | 24 working days | Get Quote |
| 10 mg | 91 USD | 95 | 24 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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| Name | File |
|---|---|
| SDF | MCULE-4169114912.sdf |
| SMILES | MCULE-4169114912.smiles |
| Standard InChI | MCULE-4169114912.inchi |
| InChIKey | MCULE-4169114912.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-886661100 | 95 | As is | in stock |
| P-889964167 | N/A | As is | by synthesis |
| P-869301020 | 95 | As is | in stock |
| P-903226603 | 95 | As is | 2.5 g |
| P-851505516 | N/A | As is | by synthesis |
| P-889817073 | 95 | As is | by synthesis |
| P-611041970 | 95 | As is | by synthesis |
| P-861399567 | 95 | As is | by synthesis |
| P-854844150 | 95 | As is | by synthesis |
| P-592709722 | 95 | As is | by synthesis |
| P-611608906 | 90 | As is | in stock |
| P-893762042 | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 225.669 |
| logP | 2.5296 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 5 |
| PSA | 46.17 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 60.5522 |
| Atoms | 27 |
| Rings | 1 |
| Heavy atoms | 15 |
| Hydrogen atoms | 12 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| 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 |
