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MCULE-9230113512
Compound
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- 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 | 115 USD | 98 | 42 working days | Get Quote |
| 5 mg | 115 USD | 98 | 42 working days | Get Quote |
| 10 mg | 115 USD | 98 | 42 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-9230113512.sdf |
| SMILES | MCULE-9230113512.smiles |
| Standard InChI | MCULE-9230113512.inchi |
| InChIKey | MCULE-9230113512.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867439145 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-853427033 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-580227055 | Aldlab Chemicals | Building Block Custom Synth | 95 | As is | by synthesis |
| P-851563182 | AmBeed | On request | N/A | As is | by synthesis |
| P-864260276 | AstaTech | Backordered BBs | 98 | As is | by synthesis |
| P-590809322 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis |
| P-580428907 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-31163606 | LaboTest | Screening Collection | 90 | As is | 10 g |
| P-868740189 | MedChemExpress | Building Blocks on demand | 95 | As is | by synthesis |
| P-886935498 | eNovation Chemicals LLC | Building Block on demand | 95 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 179.215 |
| logP | 1.1881 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 4 |
| PSA | 49.33 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 50.214 |
| Atoms | 26 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 13 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| 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 |
