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MCULE-3123237237-1
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 | 47 USD | 90 | 24 working days | Get Quote |
| 5 mg | 69 USD | 90 | 24 working days | Get Quote |
| 10 mg | 86 USD | 90 | 21 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-3123237237-1.sdf |
| SMILES | MCULE-3123237237-1.smiles |
| Standard InChI | MCULE-3123237237-1.inchi |
| InChIKey | MCULE-3123237237-1.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-860636517 | 90 | As an isomer | by synthesis |
| P-1268864717 | 90 | As an isomer | by synthesis |
| P-904507534 | 95 | As an isomer | by resynthesis (? - ? days) |
| P-851530214 | N/A | As an isomer | by synthesis |
| P-590893155 | 95 | As an isomer | by synthesis |
| P-580409845 | 95 | As an isomer | by resynthesis (? - ? days) |
| P-881679516 | N/A | As an isomer | by resynthesis (? - ? days) |
| P-579487672 | 90 | As an isomer | 1.33 g |
| P-890205813 | 90 | As an isomer | in stock |
| P-454360204 | 90 | As an isomer | 100 mg |
| P-874467074 | 95 | As an isomer | by synthesis |
| P-895606584 | 95 | As an isomer | by synthesis |
| P-424893460 | 90 | As an isomer | in stock |
| P-903748754 | 94 | As an isomer | by resynthesis (? - ? days) |
| P-611471484 | 90 | As an isomer | in stock |
| P-25490267 | 90 | As an isomer | 974 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 163.220 |
| logP | 1.8119 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 53.11 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 50.2161 |
| Atoms | 25 |
| Rings | 1 |
| Heavy atoms | 12 |
| Hydrogen atoms | 13 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| 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 |
