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MCULE-6044533117-1
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 | 6 USD | 98 | 14 working days | Get Quote |
| 5 mg | 6 USD | 98 | 14 working days | Get Quote |
| 10 mg | 6 USD | 98 | 14 working days | Get Quote |
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MCULE-1498747483-0
- Component type: Main
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MCULE-4937469311-0
- Component type: Main
-
MCULE-1096187368-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-6044533117-1.sdf |
| SMILES | MCULE-6044533117-1.smiles |
| Standard InChI | MCULE-6044533117-1.inchi |
| InChIKey | MCULE-6044533117-1.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-875748797 | N/A | As a main component | in stock |
| P-903079642 | 98 | As a main component | 12 kg |
| P-489230099 | 97 | As a main component | in stock |
| P-489220053 | 97 | As a main component | in stock |
| P-590600842 | 97 | As a main component | 13.028 g |
| P-890239515 | 98 | As a main component | 1.075 kg |
| P-674396722 | 97 | As a main component | by synthesis |
| P-868563126 | 98 | As a main component | in stock |
| P-868599101 | 95 | As a main component | in stock |
| P-856089201 | 95 | As a main component | by resynthesis (? - ? days) |
| P-852603661 | N/A | As a main component | in stock |
| P-904059734 | 95 | As a main component | by synthesis |
| P-854690958 | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 281.453 |
| logP | 4.7738 |
| H-bond acceptors | 2 |
| H-bond donors | 0 |
| Rotatable bonds | 15 |
| PSA | 40.13 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 87.9955 |
| Atoms | 53 |
| Rings | 0 |
| Heavy atoms | 20 |
| Hydrogen atoms | 33 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| 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 |
