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MCULE-7041436807
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.
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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 | 86 USD | 99 | 16 working days | Get Quote |
| 5 mg | 86 USD | 99 | 16 working days | Get Quote |
| 10 mg | 99 USD | 98 | 20 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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MCULE-3025065809
- Component type: Main
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MCULE-7223684797
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-7041436807.sdf |
| SMILES | MCULE-7041436807.smiles |
| Standard InChI | MCULE-7041436807.inchi |
| InChIKey | MCULE-7041436807.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867677540 | A2B Chem | Predominantly Building Block in stock | 99 | As is | in stock |
| P-875854099 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-596974346 | Angene | Building Blocks in stock | 98 | As is | 1.3 g |
| P-889520010 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-873250836 | Key Organics | Building Blocks | 97 | As is | 10 mg |
| P-888624049 | Key Organics | Building Blocks | 95 | As a main component | 10 mg |
| P-888624249 | Key Organics | Building Blocks | 95 | As a main component | 10 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 555.622 |
| logP | 2.1013 |
| H-bond acceptors | 12 |
| H-bond donors | 7 |
| Rotatable bonds | 19 |
| PSA | 199.95 |
| RO5 violations | 3 |
| RO3 violations | 5 |
| Refractivity | 146.509 |
| Atoms | 77 |
| Rings | 2 |
| Heavy atoms | 40 |
| Hydrogen atoms | 37 |
| Heteroatoms | 12 |
| N/O atoms | 12 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 3 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 3 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
