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MCULE-8949290010-0
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 | 104 USD | 90 | 27 working days | Get Quote |
| 5 mg | 117 USD | 90 | 27 working days | Get Quote |
| 10 mg | 137 USD | 90 | 27 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-8949290010-0.sdf |
| SMILES | MCULE-8949290010-0.smiles |
| Standard InChI | MCULE-8949290010-0.inchi |
| InChIKey | MCULE-8949290010-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-886692478 | 95 | As is | in stock |
| P-889993694 | 95 | As is | by synthesis |
| P-869297768 | 95 | As is | by resynthesis (? - ? days) |
| P-903260004 | 95 | As is | 2.5 g |
| P-851584746 | N/A | As is | by synthesis |
| P-889838995 | 95 | As is | by synthesis |
| P-611174680 | 95 | As is | by synthesis |
| P-901440651 | 95 | As is | by synthesis |
| P-605335203 | 90 | As is | in stock |
| P-895463211 | 95 | As is | by synthesis |
| P-424939791 | 90 | As is | in stock |
| P-1273032698 | 94 | As is | by resynthesis (? - ? days) |
| P-611418739 | 90 | As is | in stock |
| P-893752533 | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 181.300 |
| logP | 3.4916 |
| H-bond acceptors | 1 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 51.32 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 57.8244 |
| Atoms | 27 |
| Rings | 1 |
| Heavy atoms | 12 |
| Hydrogen atoms | 15 |
| 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 |
