MCULE-1106731228-0
- 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 | 6 USD | 98 | 14 working days | Get Quote |
| 5 mg | 6 USD | 98 | 14 working days | Get Quote |
| 10 mg | 6 USD | 98 | 14 working days | Get Quote |
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MCULE-9889097856-0
- Component type: Main
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MCULE-8464283805-0
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MCULE-7270331275-0
- Component type: Main
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MCULE-9560023707-0
- Component type: Main
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MCULE-7666590312-0
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-1106731228-0.sdf |
| SMILES | MCULE-1106731228-0.smiles |
| Standard InChI | MCULE-1106731228-0.inchi |
| InChIKey | MCULE-1106731228-0.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867572917 | 98 | As is | in stock |
| P-875733668 | 98 | As is | in stock |
| P-1275185597 | 98 | As is | in stock |
| P-903063219 | 98 | As is | 600 g |
| P-606849767 | N/A | As is | in stock |
| P-596950256 | 98 | As is | 1000 g |
| P-552048495 | 95 | As is | by resynthesis (? - ? days) |
| P-864161577 | 95 | As is | in stock |
| P-901416108 | 95 | As is | by synthesis |
| P-868614545 | 98 | As is | in stock |
| P-580277084 | 95 | As is | by resynthesis (? - ? days) |
| P-905351761 | 97 | As is | 370 g |
| P-862093805 | 97 | As is | 4.15975 kg |
| P-31249630 | 90 | As is | unavailable |
| P-856039910 | 90 | As is | unavailable |
| P-860792117 | 98 | As is | by synthesis |
| P-1273476082 | 95 | As is | in stock |
| P-620223324 | 95 | As is | 1000 mg |
| P-620068258 | 90 | As is | 1000 mg |
| P-885550462 | 95 | As is | by synthesis |
| P-502366806 | 90 | As is | in stock |
| P-611350742 | 90 | As is | in stock |
| P-1271637958 | 98 | As is | in stock |
| P-1266125290 | N/A | As a main component | in stock |
| P-892884971 | 98 | As a main component | in stock |
| P-1266259316 | N/A | As a main component | in stock |
| P-1265854465 | N/A | As a main component | in stock |
| P-890185908 | 98 | As a main component | in stock |
| P-901301615 | 98 | As a main component | in stock |
| P-903175760 | N/A | As a main component | 250 mg |
| P-903344053 | N/A | As a main component | 50 g |
| P-903344575 | 98 | As a main component | 175 g |
| P-891646758 | N/A | As a main component | by synthesis |
| P-892193350 | N/A | As a main component | 175 g |
| P-1271971179 | 99 | As a main component | 2 g |
| P-900251090 | N/A | As a main component | 25 g |
| P-1273283906 | 95 | As a main component | by resynthesis (? - ? days) |
| P-1274823567 | 95 | As a main component | by resynthesis (? - ? days) |
| P-1268675561 | 95 | As a main component | in stock |
| P-901335672 | 95 | As a main component | in stock |
| P-905520118 | 98 | As a main component | by synthesis |
| P-488555160 | 90 | As a main component | in stock |
| P-427886385 | 92 | As a main component | 300 mg |
| P-899784188 | 97 | As a main component | 250 mg |
| P-899786206 | 97 | As a main component | 250 mg |
| P-895356220 | 95 | As a main component | by synthesis |
| P-874437001 | 95 | As a main component | by synthesis |
| P-454375772 | 92 | As a main component | in stock |
| P-445318624 | 92 | As a main component | 300 mg |
| P-675129938 | 90 | As a main component | in stock |
| P-906903114 | N/A | As a main component | in stock |
| P-906889947 | N/A | As a main component | by synthesis |
| P-906907426 | 98 | As a main component | in stock |
| P-617781382 | 90 | As a main component | 1.107 g |
| P-1271659786 | 99 | As a main component | in stock |
| P-1271652303 | 95 | As a main component | in stock |
| P-894010056 | 98 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 144.258 |
| logP | 2.645 |
| H-bond acceptors | 2 |
| H-bond donors | 2 |
| Rotatable bonds | 7 |
| PSA | 52.04 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 45.9848 |
| Atoms | 30 |
| Rings | 0 |
| Heavy atoms | 10 |
| Hydrogen atoms | 20 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| 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 |

