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MCULE-9493114574
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 | 407 USD | 95 | 24 working days | Get Quote |
| 5 mg | 407 USD | 95 | 24 working days | Get Quote |
| 10 mg | 407 USD | 95 | 24 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-9493114574.sdf |
| SMILES | MCULE-9493114574.smiles |
| Standard InChI | MCULE-9493114574.inchi |
| InChIKey | MCULE-9493114574.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867643462 | A2B Chem | Predominantly Building Block in stock | 97 | As is | in stock |
| P-875809807 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-851529614 | AmBeed | On request | N/A | As is | by synthesis |
| P-590858299 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
| P-862009268 | FluoroChem | General BB | N/A | As is | in stock |
| P-852480500 | Matrix Scientific | All | N/A | As is | in stock |
| P-869068236 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-474053298 | Rieke Metals | Building Blocks | 97 | As is | in stock |
| P-535659597 | Rieke Metals | Natural Compounds | N/A | As is | in stock |
| P-855319874 | Toronto Research | In stock | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 298.332 |
| logP | 4.1625 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 7 |
| PSA | 63.6 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 84.1523 |
| Atoms | 40 |
| Rings | 2 |
| Heavy atoms | 22 |
| Hydrogen atoms | 18 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
