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UNKNOWN STEREO
MCULE-4455821959-0
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 | 7 USD | 99 | 20 working days | Get Quote |
| 5 mg | 7 USD | 99 | 20 working days | Get Quote |
| 10 mg | 7 USD | 99 | 20 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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1
MCULE-2589082817-1
- Component type: Main
-
1
MCULE-3833394421-0
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-4455821959-0.sdf |
| SMILES | MCULE-4455821959-0.smiles |
| Standard InChI | MCULE-4455821959-0.inchi |
| InChIKey | MCULE-4455821959-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-875827657 | N/A | As is | in stock |
| P-869188330 | 98 | As is | in stock |
| P-505354713 | N/A | As is | in stock |
| P-505389406 | 99 | As is | in stock |
| P-606886543 | N/A | As is | in stock |
| P-596985721 | 99 | As is | 2 kg |
| P-580195690 | 98 | As is | in stock |
| P-868545765 | 100 | As is | in stock |
| P-893234727 | 95 | As is | in stock |
| P-524443582 | 97 | As is | 4.763 g |
| P-611353930 | 90 | As is | in stock |
| P-480599540 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 252.240 |
| logP | 1.7018 |
| H-bond acceptors | 3 |
| H-bond donors | 0 |
| Rotatable bonds | 3 |
| PSA | 49.36 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 64.8495 |
| Atoms | 31 |
| Rings | 2 |
| Heavy atoms | 18 |
| Hydrogen atoms | 13 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| Inorganic atoms | 1 |
| 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 |
