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MCULE-8504854584
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 | 65 USD | 95 | 10 working days | Get Quote |
| 5 mg | 80 USD | 95 | 10 working days | Get Quote |
| 10 mg | 110 USD | 95 | 10 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-8504854584.sdf |
| SMILES | MCULE-8504854584.smiles |
| Standard InChI | MCULE-8504854584.inchi |
| InChIKey | MCULE-8504854584.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-852068158 | A2B Chem | Predominantly Building Block on demand | 95 | As is | by synthesis |
| P-875698228 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-615719118 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-866097069 | Advanced Chemical Intermediates (ACI) | ACI predominantly BB catalog | 95 | As is | unavailable |
| P-851831494 | AmBeed | On request | N/A | As is | by synthesis |
| P-590991177 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
| P-580443299 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-454378407 | Key Organics | Building Blocks | 95 | As is | 12.936 g |
| P-18795271 | Key Organics | Screening Compounds and Fragments | 95 | As is | 12.936 g |
| P-852413004 | Matrix Scientific | All | N/A | As is | in stock |
| P-864054175 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-502397075 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-611429517 | Toronto Research | In stock | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 192.240 |
| logP | 2.2191 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 74.25 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 52.334 |
| Atoms | 21 |
| Rings | 2 |
| Heavy atoms | 13 |
| Hydrogen atoms | 8 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| 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 |
