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MCULE-8771808598
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 | 754 USD | 95 | 42 working days | Get Quote |
| 5 mg | 754 USD | 95 | 42 working days | Get Quote |
| 10 mg | 754 USD | 95 | 42 working days | Get Quote |
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1
MCULE-3349388224
- Component type: Main
-
1
MCULE-7728164114
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-8771808598.sdf |
| SMILES | MCULE-8771808598.smiles |
| Standard InChI | MCULE-8771808598.inchi |
| InChIKey | MCULE-8771808598.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-492229882 | 95 | As is | in stock |
| P-1270587561 | 95 | Main component | by synthesis |
| P-1269029593 | 95 | Main component | by synthesis |
| P-874653015 | 97 | Main component | by resynthesis (? - ? days) |
| P-855373708 | 90 | Main component | in stock |
| P-891225536 | 95 | Main component | by synthesis |
| P-884909738 | 95 | Main component | by synthesis |
| P-854894414 | 95 | Main component | by synthesis |
| P-491090608 | 95 | Main component | by synthesis |
| P-33985639 | 90 | Main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 197.703 |
| logP | 3.5595 |
| H-bond acceptors | 1 |
| H-bond donors | 1 |
| Rotatable bonds | 2 |
| PSA | 26.02 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 58.3534 |
| Atoms | 29 |
| Rings | 2 |
| Heavy atoms | 13 |
| Hydrogen atoms | 16 |
| Heteroatoms | 2 |
| N/O atoms | 1 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| 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 |
