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UNKNOWN STEREO
MCULE-5054099692
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 | 11 USD | 98 | 20 working days | Get Quote |
| 5 mg | 11 USD | 98 | 20 working days | Get Quote |
| 10 mg | 11 USD | 98 | 20 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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MCULE-6188916090
- Component type: Main
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MCULE-2497863873
- Component type: Main
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MCULE-3727059767
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-5054099692.sdf |
| SMILES | MCULE-5054099692.smiles |
| Standard InChI | MCULE-5054099692.inchi |
| InChIKey | MCULE-5054099692.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867675138 | 99 | As is | in stock |
| P-875851324 | N/A | As is | in stock |
| P-881674310 | 98 | As is | in stock |
| P-596986052 | 98 | As is | 15 g |
| P-864177462 | 98 | As is | in stock |
| P-893234844 | 95 | As is | in stock |
| P-500371224 | 98 | As is | by synthesis |
| P-892268278 | 95 | As is | by synthesis |
| P-869178240 | 95 | As is | in stock |
| P-892298255 | 95 | As is | 778 mg |
| P-892347450 | 95 | As is | 778 mg |
| P-855052161 | 90 | As is | in stock |
| P-424719195 | 90 | As is | 741 mg |
| P-867627545 | 99 | As a main component | in stock |
| P-852191592 | N/A | As a main component | by synthesis |
| P-901288659 | N/A | As a main component | in stock |
| P-890156215 | N/A | As a main component | in stock |
| P-894631269 | 98 | As a main component | in stock |
| P-881102414 | 98 | As a main component | 5 g |
| P-901334844 | 95 | As a main component | in stock |
| P-855051474 | 90 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 169.178 |
| logP | 0.7902 |
| H-bond acceptors | 4 |
| H-bond donors | 4 |
| Rotatable bonds | 2 |
| PSA | 86.71 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 44.1302 |
| Atoms | 23 |
| Rings | 1 |
| Heavy atoms | 12 |
| Hydrogen atoms | 11 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| 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 | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
