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UNKNOWN STEREO
MCULE-9419487052
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 | 5 USD | 99 | 16 working days | Get Quote |
| 5 mg | 11 USD | 98 | 20 working days | Get Quote |
| 10 mg | 13 USD | 98 | 20 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-9419487052.sdf |
| SMILES | MCULE-9419487052.smiles |
| Standard InChI | MCULE-9419487052.inchi |
| InChIKey | MCULE-9419487052.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867557583 | A2B Chem | Predominantly Building Block in stock | 99 | As is | in stock |
| P-875717067 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-869181166 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-505389025 | AK Scientific | Building Blocks | 99 | As is | in stock |
| P-505395585 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-606880218 | AmBeed | In stock | N/A | As is | in stock |
| P-596943960 | Angene | Building Blocks in stock | 98 | As is | 27.76 g |
| P-864113642 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-868544072 | Axon Medchem | Axon predominantly SC catalog | 99 | As is | in stock |
| P-860799581 | Chiralstar | Chiralstar Building Blocks | 98 | As is | in stock |
| P-580426115 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-505515210 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-500395254 | Pi Chemicals | Virtual Compounds | 98 | As is | by synthesis |
| P-869175804 | TargetMol | Natural Products | 95 | As is | 5.59 g |
| P-873223275 | TimTec | Building Block Collection | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 228.206 |
| logP | -1.5576 |
| H-bond acceptors | 8 |
| H-bond donors | 3 |
| Rotatable bonds | 2 |
| PSA | 123.49 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 52.481 |
| Atoms | 28 |
| Rings | 2 |
| Heavy atoms | 16 |
| Hydrogen atoms | 12 |
| Heteroatoms | 8 |
| N/O atoms | 8 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 3 |
| R/S chiral centers | 3 |
| 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 |
