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MCULE-6044533117-0
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 | 13 USD | 98 | 11 working days | Get Quote |
| 5 mg | 13 USD | 98 | 11 working days | Get Quote |
| 10 mg | 13 USD | 98 | 11 working days | Get Quote |
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MCULE-1096187368-1
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-6044533117-0.sdf |
| SMILES | MCULE-6044533117-0.smiles |
| Standard InChI | MCULE-6044533117-0.inchi |
| InChIKey | MCULE-6044533117-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-905480114 | 90 | As is | 100 g |
| P-489229247 | 97 | As is | in stock |
| P-675187362 | 70 | As is | 90 mg |
| P-905616210 | 85 | As is | 1.4 kg |
| P-617430726 | 98 | As is | 3.03 kg |
| P-605423529 | 90 | As is | 4.795 kg |
| P-578049798 | 98 | As is | in stock |
| P-868595030 | 85 | As is | in stock |
| P-579616996 | 90 | As is | unavailable |
| P-852505354 | N/A | As is | in stock |
| P-852604288 | N/A | As is | in stock |
| P-895498464 | 95 | As is | by synthesis |
| P-902990739 | 95 | As is | by synthesis |
| P-854691017 | 95 | As is | in stock |
| P-584623248 | 95 | As is | in stock |
| P-870132516 | 97 | As is | in stock |
| P-895524019 | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 282.461 |
| logP | 6.1085 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 15 |
| PSA | 37.3 |
| RO5 violations | 1 |
| RO3 violations | 2 |
| Refractivity | 89.9378 |
| Atoms | 54 |
| Rings | 0 |
| Heavy atoms | 20 |
| Hydrogen atoms | 34 |
| 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 |
