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MCULE-8453668289-0
Structure
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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 | 276 USD | 95 | 9 working days | Get Quote |
| 5 mg | 276 USD | 95 | 9 working days | Get Quote |
| 10 mg | 276 USD | 95 | 9 working days | Get Quote |
New customers are eligible for 10% discount if indicated at the time of ordering.
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1
MCULE-8801511471-0
- Component type: Main
-
1
MCULE-7728164114-1
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-8453668289-0.sdf |
| SMILES | MCULE-8453668289-0.smiles |
| Standard InChI | MCULE-8453668289-0.inchi |
| InChIKey | MCULE-8453668289-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability | Updated |
|---|---|---|---|---|---|---|
| P-588138359 | Advamacs (TriMen Chemicals) | All | 95 | As is | in stock | April 18, 2019 |
| P-596999882 | Angene | Building Blocks | 95 | As is | in stock | February 1 |
| P-590921361 | BLD pharm | Non-stock building blocks | 95 | As is | by synthesis | May 28 |
| P-584353055 | ChemScene | Stock compounds | 98 | As is | unavailable | June 28 |
| P-487233031 | Enamine | Building Blocks | 90 | As is | in stock | February 18 |
| P-596577360 | Key Organics | Building Blocks | 95 | As is | 1000 mg | June 24 |
| P-596581013 | Key Organics | Building Blocks | 95 | As is | 1000 mg | June 24 |
| P-524169648 | Key Organics | Building Blocks | 98 | As is | 5 g | June 24 |
| P-505478205 | BOCSCI | All products | 97 | Main component | in stock | July 6, 2017 |
| P-487230994 | Enamine | Building Blocks | 90 | Main component | in stock | February 18 |
| P-564666353 | FCH Group | Building Blocks | 95 | Main component | by synthesis | January 15, 2018 |
| P-505538482 | Hangzhou Apichem | All products | 95 | Main component | in stock | June 30, 2017 |
| P-579622459 | LabSeeker, Inc | Stock Collection | 97 | Main component | in stock | August 11, 2017 |
| P-491105735 | Princeton Biomolecular Research | Building Block Libraries | 95 | Main component | in stock | August 1, 2017 |
| P-33986313 | TimTec | ActiMol 6 Week | 90 | Main component | in stock | April 1, 2014 |
| P-502389440 | TimTec | Building Block Collection | 90 | Main component | in stock | February 1, 2015 |
| P-580061596 | eNovation Chemicals LLC | Building Blocks | 96 | Main component | in stock | January 22, 2019 |
| P-524194423 | Key Organics | Building Blocks | 95 | Main component as a main component | 1000 mg | June 24 |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 205.630 |
| logP | 3.2817 |
| H-bond acceptors | 1 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 26.02 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 48.4964 |
| Atoms | 23 |
| Rings | 2 |
| Heavy atoms | 13 |
| Hydrogen atoms | 10 |
| Heteroatoms | 4 |
| N/O atoms | 1 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| Chiral centers | 2 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 2 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
