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MCULE-8116822014
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 | 34 USD | 90 | 19 working days | Get Quote |
| 5 mg | 51 USD | 90 | 19 working days | Get Quote |
| 10 mg | 65 USD | 90 | 19 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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| Name | File |
|---|---|
| SDF | MCULE-8116822014.sdf |
| SMILES | MCULE-8116822014.smiles |
| Standard InChI | MCULE-8116822014.inchi |
| InChIKey | MCULE-8116822014.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-893085507 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-867412355 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-4492912 | ChemDiv | Discovery Chemistry Library | 90 | As is | 22 mg |
| P-492222326 | Innovapharm | Building Blocks | 95 | As is | in stock |
| P-502721426 | Innovapharm | Screening Compounds | 90 | As is | in stock |
| P-502501567 | Innovapharm | Virtual Building Blocks | 95 | As is | by synthesis |
| P-503472841 | Innovapharm | Virtual Screening Compounds | 90 | As is | by synthesis |
| P-596591983 | Key Organics | Building Blocks | 90 | As is | 500 mg |
| P-35185061 | Maybridge | Screening Collection | 90 | As is | 10.661 kg |
| P-12843201 | Otava | In-House Stock Library | 90 | As is | 2.415 g |
| P-492283629 | Otava | Chemical Building Blocks for Prompt Delivery | 95 | As is | 2.415 g |
| P-19010157 | Princeton Biomolecular Research | Screening Compounds | 90 | As is | in stock |
| P-885526966 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-22815712 | TimTec | ActiMol 3 Week | 90 | As is | in stock |
| P-502338580 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611479517 | Toronto Research | In stock | 90 | As is | in stock |
| P-464674118 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 2.089 g |
| P-1013262 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 2.089 g |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 249.219 |
| logP | 1.1255 |
| H-bond acceptors | 6 |
| H-bond donors | 2 |
| Rotatable bonds | 6 |
| PSA | 92.7 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 62.946 |
| Atoms | 29 |
| Rings | 1 |
| Heavy atoms | 18 |
| Hydrogen atoms | 11 |
| Heteroatoms | 6 |
| N/O atoms | 6 |
| 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 |
