MCULE-9753394240
- 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 | 17 USD | 95 | 14 working days | Get Quote |
| 5 mg | 17 USD | 95 | 14 working days | Get Quote |
| 10 mg | 17 USD | 95 | 14 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-9753394240.sdf |
| SMILES | MCULE-9753394240.smiles |
| Standard InChI | MCULE-9753394240.inchi |
| InChIKey | MCULE-9753394240.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867660090 | 95 | As is | in stock |
| P-875828375 | 95 | As is | in stock |
| P-1275160522 | 95 | As is | in stock |
| P-903202900 | 95 | As is | 150 g |
| P-1270311344 | 95 | As is | in stock |
| P-606859899 | N/A | As is | in stock |
| P-865926196 | 97 | As is | 50 g |
| P-1274792512 | 95 | As is | 2 g |
| P-864153388 | 95 | As is | in stock |
| P-5160195 | 90 | As is | 100 mg |
| P-619933733 | 90 | As is | by synthesis |
| P-3319340 | 90 | As is | 140 mg |
| P-46335 | 90 | As is | 832 mg |
| P-436456909 | 95 | As is | in stock |
| P-425208747 | 90 | As is | in stock |
| P-901650937 | 95 | As is | in stock |
| P-34747618 | 90 | As is | by synthesis |
| P-580430848 | 95 | As is | by resynthesis (? - ? days) |
| P-862056682 | 95 | As is | 50 g |
| P-675214737 | 95 | As is | in stock |
| P-502445195 | 95 | As is | by synthesis |
| P-503035629 | 90 | As is | by synthesis |
| P-492222621 | 95 | As is | in stock |
| P-675514544 | 95 | As is | in stock |
| P-502616630 | 90 | As is | in stock |
| P-502656506 | 90 | As is | in stock |
| P-1275297453 | 90 | As is | 10 mg |
| P-488545700 | 90 | As is | in stock |
| P-12411184 | 92 | As is | 152 mg |
| P-454376598 | 95 | As is | 9.756 g |
| P-18789044 | 95 | As is | 9.756 g |
| P-580503066 | N/A | As is | by synthesis |
| P-1272576156 | N/A | As is | 25 g |
| P-852429477 | N/A | As is | by synthesis |
| P-35159469 | 90 | As is | in stock |
| P-637373338 | 90 | As is | by synthesis |
| P-492284055 | 95 | As is | 1.223 g |
| P-12799494 | 90 | As is | 50 mg |
| P-12893028 | 90 | As is | 1.223 g |
| P-454370579 | 92 | As is | in stock |
| P-13505470 | 92 | As is | 9 mg |
| P-13718752 | 92 | As is | 300 mg |
| P-885517746 | 95 | As is | by synthesis |
| P-889866962 | 95 | As is | by synthesis |
| P-18822126 | 90 | As is | in stock |
| P-18828052 | 90 | As is | in stock |
| P-424808525 | 90 | As is | in stock |
| P-22566684 | 90 | As is | in stock |
| P-502338909 | 90 | As is | in stock |
| P-873215730 | 90 | As is | in stock |
| P-903593294 | 94 | As is | by resynthesis (? - ? days) |
| P-903628114 | 94 | As is | by resynthesis (? - ? days) |
| P-903627232 | 94 | As is | by resynthesis (? - ? days) |
| P-906827928 | 97 | As is | by synthesis |
| P-906839745 | 98 | As is | by synthesis |
| P-855231218 | 90 | As is | in stock |
| P-614040 | 90 | As is | 1.186 g |
| P-1091769 | 90 | As is | 467 mg |
| P-1271719217 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 276.356 |
| logP | 2.7001 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 4 |
| PSA | 82.45 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 84.9784 |
| Atoms | 35 |
| Rings | 2 |
| Heavy atoms | 19 |
| Hydrogen atoms | 16 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |

