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MCULE-2744018669
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 | 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 |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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MCULE-7804985908
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-2744018669.sdf |
| SMILES | MCULE-2744018669.smiles |
| Standard InChI | MCULE-2744018669.inchi |
| InChIKey | MCULE-2744018669.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-903292273 | 97 | As is | 75 g |
| P-904065536 | 95 | As is | by synthesis |
| P-854721207 | 95 | As is | in stock |
| P-474022134 | 95 | As is | in stock |
| P-619674051 | 98 | As is | in stock |
| P-868644598 | 98 | As a main component | in stock |
| P-896626953 | 95 | As a main component | by synthesis |
| P-854716462 | 95 | As a main component | in stock |
| P-474022137 | 95 | As a main component | in stock |
| P-608276412 | 98 | As a main component | in stock |
| P-505389557 | 95 | As an isomer | in stock |
| P-505353427 | 98 | As an isomer | in stock |
| P-896027859 | 95 | As an isomer | in stock |
| P-893218356 | 95 | As an isomer | in stock |
| P-505495269 | 95 | As an isomer | in stock |
| P-638140899 | 90 | As an isomer | by synthesis |
| P-500411478 | N/A | As an isomer | by synthesis |
| P-869163184 | 95 | As an isomer | by synthesis |
| P-892298929 | 95 | As an isomer | 1.112 g |
| P-888658574 | 95 | As an isomer | 1.112 g |
| P-855050504 | 90 | As an isomer | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 455.470 |
| logP | 0.2875 |
| H-bond acceptors | 12 |
| H-bond donors | 3 |
| Rotatable bonds | 9 |
| PSA | 227.05 |
| RO5 violations | 1 |
| RO3 violations | 4 |
| Refractivity | 109.8969 |
| Atoms | 47 |
| Rings | 3 |
| Heavy atoms | 30 |
| Hydrogen atoms | 17 |
| Heteroatoms | 14 |
| N/O atoms | 12 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 2 |
| R/S chiral centers | 2 |
| 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 |
