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MCULE-2391493295-1
Structure
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- InChIKey:
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- InChI:
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| 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 | 95 | 22 working days | Get Quote |
| 5 mg | 104 USD | 95 | 22 working days | Get Quote |
| 10 mg | 104 USD | 95 | 22 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-2391493295-1.sdf |
| SMILES | MCULE-2391493295-1.smiles |
| Standard InChI | MCULE-2391493295-1.inchi |
| InChIKey | MCULE-2391493295-1.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-886624962 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-889932488 | AA Blocks | AA Blocks - synthesis | N/A | As is | by synthesis |
| P-851641102 | AmBeed | On request | N/A | As is | by synthesis |
| P-864219230 | AstaTech | Backordered BBs | 95 | As is | by synthesis |
| P-590990849 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
| P-851266458 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-862031494 | FluoroChem | General BB | 95 | As is | in stock |
| P-563494375 | Key Organics | Building Blocks | 95 | As is | 250 mg |
| P-886953916 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 227.646 |
| logP | 2.1883 |
| H-bond acceptors | 5 |
| H-bond donors | 4 |
| Rotatable bonds | 5 |
| PSA | 85.21 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 57.6936 |
| Atoms | 25 |
| Rings | 1 |
| Heavy atoms | 15 |
| Hydrogen atoms | 10 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
