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MCULE-1752814872
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 | 53 USD | 98 | 16 working days | Get Quote |
| 5 mg | 234 USD | 98 | 16 working days | Get Quote |
| 10 mg | 384 USD | 98 | 16 working days | Get Quote |
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MCULE-1828141050
- Component type: Main
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MCULE-1655721543
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-1752814872.sdf |
| SMILES | MCULE-1752814872.smiles |
| Standard InChI | MCULE-1752814872.inchi |
| InChIKey | MCULE-1752814872.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867612634 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-875772671 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-579480028 | DC Chemicals Limited | Stock Products | 95 | As is | in stock |
| P-888622189 | Key Organics | Building Blocks | 95 | As is | 1 mg |
| P-873251976 | Key Organics | Building Blocks | 97 | As a main component | 5 mg |
| P-524167288 | Key Organics | Building Blocks | 95 | As a main component | 10 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 539.067 |
| logP | 4.3339 |
| H-bond acceptors | 9 |
| H-bond donors | 3 |
| Rotatable bonds | 7 |
| PSA | 114.63 |
| RO5 violations | 1 |
| RO3 violations | 5 |
| Refractivity | 151.4868 |
| Atoms | 73 |
| Rings | 6 |
| Heavy atoms | 38 |
| Hydrogen atoms | 35 |
| Heteroatoms | 10 |
| N/O atoms | 9 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 5 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 5 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
