MCULE-2236160968-0
- 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 | 7 USD | 98 | 14 working days | Get Quote |
| 5 mg | 7 USD | 98 | 14 working days | Get Quote |
| 10 mg | 9 USD | 98 | 14 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-2236160968-0.sdf |
| SMILES | MCULE-2236160968-0.smiles |
| Standard InChI | MCULE-2236160968-0.inchi |
| InChIKey | MCULE-2236160968-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867602941 | 98 | As is | in stock |
| P-875760816 | 98 | As is | in stock |
| P-1275193265 | 98 | As is | in stock |
| P-903096577 | 98 | As is | 20 g |
| P-1264049725 | 95 | As is | in stock |
| P-893524350 | 90 | As is | 147.986 g |
| P-1270365363 | 98 | As is | in stock |
| P-606879304 | N/A | As is | in stock |
| P-489132337 | 97 | As is | in stock |
| P-25943179 | 70 | As is | 26 mg |
| P-596959777 | 98 | As is | 20 g |
| P-1273451600 | 95 | As is | by resynthesis (? - ? days) |
| P-1273458827 | 95 | As is | by resynthesis (? - ? days) |
| P-864144676 | 95 | As is | in stock |
| P-900154594 | 98 | As is | in stock |
| P-580721343 | 98 | As is | 7.6 g |
| P-900268223 | N/A | As is | by resynthesis (? - ? days) |
| P-893235560 | 95 | As is | in stock |
| P-452656210 | 98 | As is | in stock |
| P-861472766 | 95 | As is | by synthesis |
| P-579476927 | 95 | As is | in stock |
| P-862028123 | 98 | As is | 477 mg |
| P-870661286 | 98 | As is | in stock |
| P-505513146 | 95 | As is | in stock |
| P-488556101 | 92 | As is | in stock |
| P-856009514 | 97 | As is | 100 mg |
| P-579616717 | 98 | As is | in stock |
| P-1272588166 | 95 | As is | 10 g |
| P-852465844 | 95 | As is | by synthesis |
| P-854693809 | 95 | As is | in stock |
| P-904073511 | 95 | As is | in stock |
| P-888171058 | 98 | As is | by synthesis |
| P-885547203 | 95 | As is | by synthesis |
| P-868145411 | 90 | As is | in stock |
| P-579712079 | 98 | As is | in stock |
| P-896088306 | 80 | As is | 2 mg |
| P-869176308 | 95 | As is | in stock |
| P-892292846 | 95 | As is | unavailable |
| P-892237861 | 95 | As is | 64 mg |
| P-892327963 | 95 | As is | 64 mg |
| P-33162671 | 90 | As is | 153 mg |
| P-611375871 | 90 | As is | in stock |
| P-594195403 | 90 | As is | 110 mg |
| P-1271672315 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 186.163 |
| logP | 2.5392 |
| H-bond acceptors | 3 |
| H-bond donors | 0 |
| Rotatable bonds | 0 |
| PSA | 43.35 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 52.256 |
| Atoms | 20 |
| Rings | 3 |
| Heavy atoms | 14 |
| Hydrogen atoms | 6 |
| 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 | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |

