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MCULE-1612189543
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 | 5 USD | 98 | 14 working days | Get Quote |
| 5 mg | 5 USD | 98 | 14 working days | Get Quote |
| 10 mg | 5 USD | 98 | 14 working days | Get Quote |
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MCULE-5554922029
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-1612189543.sdf |
| SMILES | MCULE-1612189543.smiles |
| Standard InChI | MCULE-1612189543.inchi |
| InChIKey | MCULE-1612189543.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-903058591 | 98 | As is | 2 kg |
| P-905489192 | 97 | As is | 100 g |
| P-579788483 | 95 | As is | 200 g |
| P-860055096 | 98 | As is | by synthesis |
| P-902966961 | 98 | As is | 30 g |
| P-452660416 | 98 | As is | in stock |
| P-851274368 | 95 | As is | by synthesis |
| P-901577575 | 95 | As is | in stock |
| P-854691584 | 95 | As is | in stock |
| P-474022259 | 95 | As is | in stock |
| P-608275446 | 98 | As is | in stock |
| P-1263956328 | 90 | As is | in stock |
| P-579710474 | N/A | As is | in stock |
| P-903047628 | 97 | As a main component | 1000 g |
| P-901018347 | 95 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 392.571 |
| logP | 4.4779 |
| H-bond acceptors | 4 |
| H-bond donors | 3 |
| Rotatable bonds | 4 |
| PSA | 77.76 |
| RO5 violations | 0 |
| RO3 violations | 5 |
| Refractivity | 112.6014 |
| Atoms | 68 |
| Rings | 4 |
| Heavy atoms | 28 |
| Hydrogen atoms | 40 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 10 |
| R/S chiral centers | 10 |
| 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 |
