MCULE-8832669635
- 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 | 36 USD | 95 | 7 working days | Get Quote |
| 5 mg | 52 USD | 98 | 16 working days | Get Quote |
| 10 mg | 83 USD | 98 | 16 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-8832669635.sdf |
| SMILES | MCULE-8832669635.smiles |
| Standard InChI | MCULE-8832669635.inchi |
| InChIKey | MCULE-8832669635.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867607478 | N/A | As is | in stock |
| P-875766058 | 98 | As is | in stock |
| P-613848275 | 95 | As is | by resynthesis (? - ? days) |
| P-903103930 | 98 | As is | 500 mg |
| P-1264050043 | 99 | As is | in stock |
| P-893546711 | 90 | As is | 2.955 g |
| P-1270383652 | 98 | As is | in stock |
| P-851859446 | N/A | As is | by synthesis |
| P-865913667 | 97 | As is | 800 mg |
| P-1273451165 | 95 | As is | by resynthesis (? - ? days) |
| P-889772957 | 95 | As is | in stock |
| P-860054667 | 98 | As is | by synthesis |
| P-591003697 | 97 | As is | by synthesis |
| P-901455217 | 95 | As is | by synthesis |
| P-452655178 | 98 | As is | in stock |
| P-887206970 | 95 | As is | by synthesis |
| P-579477310 | 95 | As is | in stock |
| P-905430980 | 97 | As is | 740 mg |
| P-505524709 | 95 | As is | in stock |
| P-873242082 | 97 | As is | 5 mg |
| P-854693651 | 95 | As is | in stock |
| P-896629315 | 95 | As is | by synthesis |
| P-872666058 | 95 | As is | in stock |
| P-608279549 | 98 | As is | in stock |
| P-869177964 | 95 | As is | in stock |
| P-892296407 | 95 | As is | unavailable |
| P-580051756 | 95 | As is | 151 mg |
| P-892338789 | 95 | As is | 151 mg |
| P-886924138 | 97 | As is | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 178.141 |
| logP | 1.2042 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 0 |
| PSA | 70.67 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 46.53 |
| Atoms | 19 |
| Rings | 2 |
| Heavy atoms | 13 |
| Hydrogen atoms | 6 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| 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 | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |

