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MCULE-9864796653
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 | 97 | 9 working days | Get Quote |
| 5 mg | 5 USD | 97 | 9 working days | Get Quote |
| 10 mg | 5 USD | 97 | 9 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-9864796653.sdf |
| SMILES | MCULE-9864796653.smiles |
| Standard InChI | MCULE-9864796653.inchi |
| InChIKey | MCULE-9864796653.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-610978015 | Advanced ChemBlocks Inc (AChemBlock) | In stock | 90 | As is | 5.19465 kg |
| P-494343188 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-580698259 | BLD pharm | In-stock building blocks | 97 | As is | 312.25 g |
| P-851266552 | Chemshuttle | On request catalog | 95 | As is | by synthesis |
| P-868644827 | Combi-Blocks | Building Block in stock | 97 | As is | in stock |
| P-505626955 | Endotherm | Endotherm General Catalog | 95 | As is | in stock |
| P-889113762 | FluoroChem | In Stock BB | N/A | As is | 1000 mg |
| P-579611752 | LabSeeker, Inc | Stock Collection | 98 | As is | in stock |
| P-852451704 | Matrix Scientific | All | N/A | As is | in stock |
| P-854724112 | MedChemExpress | In stock Building Blocks | 95 | As is | in stock |
| P-873281651 | Shanghai iChemical | In stock | N/A | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 118.131 |
| logP | 0.0879 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 2 |
| PSA | 57.53 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 29.0826 |
| Atoms | 18 |
| Rings | 0 |
| Heavy atoms | 8 |
| Hydrogen atoms | 10 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |
