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UNKNOWN STEREO
MCULE-6760819058-0
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 | 96 | 20 working days | Get Quote |
| 5 mg | 7 USD | 96 | 20 working days | Get Quote |
| 10 mg | 7 USD | 96 | 20 working days | Get Quote |
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MCULE-1611060784-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-6760819058-0.sdf |
| SMILES | MCULE-6760819058-0.smiles |
| Standard InChI | MCULE-6760819058-0.inchi |
| InChIKey | MCULE-6760819058-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867586510 | 98 | As is | in stock |
| P-875745928 | 98 | As is | in stock |
| P-1275198018 | 98 | As is | in stock |
| P-606872235 | N/A | As is | in stock |
| P-596954733 | 96 | As is | 800 g |
| P-864185187 | 95 | As is | in stock |
| P-449242727 | 90 | As is | 72 mg |
| P-580451401 | 99 | As is | in stock |
| P-428630761 | 90 | As is | in stock |
| P-580005876 | 95 | As is | in stock |
| P-502967178 | 90 | As is | in stock |
| P-34031331 | 90 | As is | 500 mg |
| P-500386349 | 98 | As is | by synthesis |
| P-869164493 | 95 | As is | 999 mg |
| P-892300467 | 95 | As is | 999 mg |
| P-888659656 | 95 | As is | 999 mg |
| P-1263088103 | N/A | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 219.199 |
| logP | 0.5892 |
| H-bond acceptors | 9 |
| H-bond donors | 5 |
| Rotatable bonds | 8 |
| PSA | 157.05 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 52.7343 |
| Atoms | 28 |
| Rings | 0 |
| Heavy atoms | 15 |
| Hydrogen atoms | 13 |
| Heteroatoms | 9 |
| N/O atoms | 9 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 0 |
| Stereo double bonds | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
