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MCULE-9120078665-0
Structure
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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 | 44 USD | 90 | 21 working days | Get Quote |
| 5 mg | 71 USD | 90 | 21 working days | Get Quote |
| 10 mg | 86 USD | 90 | 21 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-9120078665-0.sdf |
| SMILES | MCULE-9120078665-0.smiles |
| Standard InChI | MCULE-9120078665-0.inchi |
| InChIKey | MCULE-9120078665-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-852179720 | A2B Chem | Predominantly Building Block on demand | 97 | As is | by synthesis |
| P-454642617 | ChemDiv | Building Blocks in stock | 90 | As is | in stock |
| P-9908527 | ChemDiv | Discovery Chemistry Library | 90 | As is | 63 mg |
| P-864030265 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-12409373 | Otava | In-House Stock Library | 90 | As is | 91 mg |
| P-617687807 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 91 mg |
| P-856069794 | Princeton Biomolecular Research | Building Block Stock | 95 | As is | 28.4 g |
| P-855214315 | Toronto Research | In stock | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 235.235 |
| logP | 1.2601 |
| H-bond acceptors | 5 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 66.84 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 64.5138 |
| Atoms | 30 |
| Rings | 2 |
| Heavy atoms | 17 |
| Hydrogen atoms | 13 |
| Heteroatoms | 5 |
| N/O atoms | 5 |
| 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 | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
