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MCULE-1147892657
Compound
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- InChIKey:
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- 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.
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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 | 65 USD | 95 | 10 working days | Get Quote |
| 5 mg | 81 USD | 95 | 10 working days | Get Quote |
| 10 mg | 111 USD | 95 | 10 working days | Get Quote |
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MCULE-1208474656
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-1147892657.sdf |
| SMILES | MCULE-1147892657.smiles |
| Standard InChI | MCULE-1147892657.inchi |
| InChIKey | MCULE-1147892657.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-852129932 | A2B Chem | Predominantly Building Block on demand | 95 | As a main component | by synthesis |
| P-851493235 | AmBeed | On request | N/A | As a main component | by synthesis |
| P-494307935 | Apollo Scientific | On request | 95 | As a main component | by resynthesis (? - ? days) |
| P-855908698 | Key Organics | Building Blocks | 95 | As a main component | 4.529 g |
| P-856004252 | Key Organics | Screening Compounds and Fragments | 95 | As a main component | 4.529 g |
| P-855331142 | Toronto Research | In stock | 90 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 274.239 |
| logP | 3.2538 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 6 |
| PSA | 64.35 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 63.4961 |
| Atoms | 32 |
| Rings | 1 |
| Heavy atoms | 19 |
| Hydrogen atoms | 13 |
| Heteroatoms | 7 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| 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 | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
