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MCULE-5038636902-2
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.
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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.
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|
|---|---|---|---|---|
| 1 mg | 233 USD | N/A | 22 working days | Get Quote |
| 5 mg | 233 USD | N/A | 22 working days | Get Quote |
| 10 mg | 233 USD | N/A | 22 working days | Get Quote |
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MCULE-8967527954-0
- Component type: Main
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MCULE-3311358477-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-5038636902-2.sdf |
| SMILES | MCULE-5038636902-2.smiles |
| Standard InChI | MCULE-5038636902-2.inchi |
| InChIKey | MCULE-5038636902-2.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867456589 | A2B Chem | Predominantly Building Block on demand | N/A | As a main component | by synthesis |
| P-616209634 | AK Scientific | Building Blocks | 95 | As a main component | in stock |
| P-852427958 | Matrix Scientific | All | N/A | As a main component | in stock |
| P-873225758 | TimTec | Building Block Collection | 90 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 218.080 |
| logP | 2.0277 |
| H-bond acceptors | 7 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 125.22 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 46.4038 |
| Atoms | 19 |
| Rings | 1 |
| Heavy atoms | 14 |
| Hydrogen atoms | 5 |
| Heteroatoms | 8 |
| N/O atoms | 7 |
| 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 |
