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MCULE-9514771889-2
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.
|
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 | 45 USD | 98 | 20 working days | Get Quote |
| 5 mg | 45 USD | 98 | 20 working days | Get Quote |
| 10 mg | 45 USD | 98 | 20 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-9514771889-2.sdf |
| SMILES | MCULE-9514771889-2.smiles |
| Standard InChI | MCULE-9514771889-2.inchi |
| InChIKey | MCULE-9514771889-2.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867546037 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-890140104 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-613855707 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-893582065 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 69.982 g |
| P-873289396 | Angene | Building Blocks in stock | 98 | As is | 20 g |
| P-895946882 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-896544163 | Combi-Blocks | Building Block in stock | 96 | As is | in stock |
| P-872796986 | MedChemExpress | Building Blocks in stock | 95 | As is | in stock |
| P-855345892 | Toronto Research | In stock | 90 | As is | in stock |
| P-868539404 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 146.149 |
| logP | 0.8667 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 54.46 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 39.6137 |
| Atoms | 17 |
| Rings | 2 |
| Heavy atoms | 11 |
| Hydrogen atoms | 6 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| 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 |
