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MCULE-1113222985
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 | 13 USD | 98 | 11 working days | Get Quote |
| 5 mg | 13 USD | 98 | 11 working days | Get Quote |
| 10 mg | 13 USD | 98 | 11 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-1113222985.sdf |
| SMILES | MCULE-1113222985.smiles |
| Standard InChI | MCULE-1113222985.inchi |
| InChIKey | MCULE-1113222985.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-875729488 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-489119991 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As is | in stock |
| P-889740712 | Atlantic Research Chemicals Ltd | In-stock Building Blocks | 95 | As is | 2.4 kg |
| P-881633715 | Chemfaces | Natural Compounds | 98 | As is | in stock |
| P-868612616 | Combi-Blocks | Building Block in stock | 98 | As is | in stock |
| P-852504791 | Matrix Scientific | All | N/A | As is | in stock |
| P-896629416 | MedChemExpress | Screening compounds on demand | 95 | As is | by synthesis |
| P-854693510 | MedChemExpress | Natural Products In stock | 95 | As is | in stock |
| P-584621128 | MedKoo | In stock compounds | 95 | As is | in stock |
| P-619672475 | Molnova | Stock | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 116.072 |
| logP | -0.2882 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 2 |
| PSA | 74.6 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 24.4116 |
| Atoms | 12 |
| Rings | 0 |
| Heavy atoms | 8 |
| Hydrogen atoms | 4 |
| 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 | 1 |
| Cis/trans stereo double bonds | 1 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
