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MCULE-2689816812
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 | 27 USD | 99 | 20 working days | Get Quote |
| 5 mg | 27 USD | 99 | 20 working days | Get Quote |
| 10 mg | 27 USD | 99 | 20 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-2689816812.sdf |
| SMILES | MCULE-2689816812.smiles |
| Standard InChI | MCULE-2689816812.inchi |
| InChIKey | MCULE-2689816812.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-875822323 | 98 | As is | in stock |
| P-903184900 | 98 | As is | 75 g |
| P-489166290 | 97 | As is | in stock |
| P-851297349 | 95 | As is | by synthesis |
| P-861477725 | 95 | As is | by synthesis |
| P-579479424 | 95 | As is | in stock |
| P-852604074 | 98 | As is | by synthesis |
| P-854712250 | 95 | As is | in stock |
| P-904060360 | 95 | As is | by synthesis |
| P-584626511 | 95 | As is | in stock |
| P-888172246 | 98 | As is | by synthesis |
| P-867654302 | 98 | As an isomer | in stock |
| P-1275197243 | 95 | As an isomer | in stock |
| P-1264048855 | 100 | As an isomer | in stock |
| P-1270311223 | 98 | As an isomer | in stock |
| P-851949635 | N/A | As an isomer | in stock |
| P-597006584 | 99 | As an isomer | 27 g |
| P-1273266892 | 95 | As an isomer | by resynthesis (? - ? days) |
| P-895929972 | 95 | As an isomer | by resynthesis (? - ? days) |
| P-864150703 | 95 | As an isomer | in stock |
| P-901464770 | 95 | As an isomer | by synthesis |
| P-34858955 | 90 | As an isomer | in stock |
| P-580762664 | 90 | As an isomer | by synthesis |
| P-870646385 | N/A | As an isomer | in stock |
| P-596579145 | 97 | As an isomer | 250 mg |
| P-870640906 | 97 | As an isomer | 100 mg |
| P-31131056 | 90 | As an isomer | 1000 mg |
| P-580484414 | 98 | As an isomer | by synthesis |
| P-888878687 | N/A | As an isomer | in stock |
| P-500399216 | 98 | As an isomer | by synthesis |
| P-856970032 | 95 | As an isomer | by synthesis |
| P-19626460 | 90 | As an isomer | in stock |
| P-892299271 | 95 | As an isomer | unavailable |
| P-869163322 | 95 | As an isomer | 201 mg |
| P-888658694 | 95 | As an isomer | 201 mg |
| P-888438571 | 94 | As an isomer | by resynthesis (? - ? days) |
| P-578063317 | 90 | As an isomer | 644 mg |
| P-1271719860 | 98 | As an isomer | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 236.296 |
| logP | 1.9763 |
| H-bond acceptors | 5 |
| H-bond donors | 3 |
| Rotatable bonds | 5 |
| PSA | 111.6 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 67.5128 |
| Atoms | 28 |
| Rings | 1 |
| Heavy atoms | 16 |
| Hydrogen atoms | 12 |
| Heteroatoms | 6 |
| N/O atoms | 5 |
| 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 |
