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MCULE-1309002877-0
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 | 73 USD | 98 | 22 working days | Get Quote |
| 5 mg | 117 USD | 95 | 21 working days | Get Quote |
| 10 mg | 117 USD | 95 | 21 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-1309002877-0.sdf |
| SMILES | MCULE-1309002877-0.smiles |
| Standard InChI | MCULE-1309002877-0.inchi |
| InChIKey | MCULE-1309002877-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867576642 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-867623993 | A2B Chem | Predominantly Building Block in stock | 98 | As is | in stock |
| P-590412680 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-869371493 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-851756325 | AmBeed | On request | N/A | As is | by synthesis |
| P-596988171 | Angene | Building Blocks in stock | 98 | As is | 35 g |
| P-864174796 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-580302514 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-862094379 | FluoroChem | General BB | N/A | As is | in stock |
| P-596565281 | Key Organics | Building Blocks | 97 | As is | 1000 mg |
| P-869159197 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-888654814 | TargetMol | Screening Compounds - stock amount | 95 | As is | unavailable |
| P-855366769 | Toronto Research | In stock | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 254.408 |
| logP | 5.3283 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 13 |
| PSA | 37.3 |
| RO5 violations | 1 |
| RO3 violations | 2 |
| Refractivity | 80.3238 |
| Atoms | 48 |
| Rings | 0 |
| Heavy atoms | 18 |
| Hydrogen atoms | 30 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| 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 | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
