MCULE-4120011833
- 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.
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|
|---|---|---|---|---|
| 1 mg | 6 USD | 97 | 22 working days | Get Quote |
| 5 mg | 6 USD | 97 | 22 working days | Get Quote |
| 10 mg | 6 USD | 97 | 22 working days | Get Quote |
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MCULE-8314174538
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-4120011833.sdf |
| SMILES | MCULE-4120011833.smiles |
| Standard InChI | MCULE-4120011833.inchi |
| InChIKey | MCULE-4120011833.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867405167 | 95 | As is | by synthesis |
| P-1268874092 | 95 | As is | by synthesis |
| P-853443032 | 95 | As is | by resynthesis (? - ? days) |
| P-591071330 | 95 | As is | by synthesis |
| P-851288517 | 95 | As is | by synthesis |
| P-580393429 | N/A | As is | by resynthesis (? - ? days) |
| P-881675610 | N/A | As is | by resynthesis (? - ? days) |
| P-500159376 | 96 | As is | in stock |
| P-854912965 | 95 | As is | by synthesis |
| P-854668901 | 95 | As is | in stock |
| P-867561537 | 97 | As a main component | in stock |
| P-875722112 | 97 | As a main component | in stock |
| P-597016246 | 95 | As a main component | unavailable |
| P-1275154045 | 95 | As a main component | in stock |
| P-1275189411 | 98 | As a main component | in stock |
| P-903051370 | 98 | As a main component | 6.415 kg |
| P-905478206 | 97 | As a main component | 1000 g |
| P-1275574631 | 90 | As a main component | 22.2371 kg |
| P-1270315082 | 97 | As a main component | in stock |
| P-580241897 | 95 | As a main component | by synthesis |
| P-617065817 | 95 | As a main component | in stock |
| P-606866512 | N/A | As a main component | in stock |
| P-489148977 | 97 | As a main component | in stock |
| P-596945635 | 98 | As a main component | 10 kg |
| P-494350837 | 95 | As a main component | 171 g |
| P-864120296 | 95 | As a main component | in stock |
| P-481174445 | 95 | As a main component | 25 g |
| P-907572400 | 95 | As a main component | by synthesis |
| P-580725735 | 97 | As a main component | 850 g |
| P-893260476 | 95 | As a main component | by synthesis |
| P-893361367 | 90 | As a main component | 1000 mg |
| P-617649384 | 90 | As a main component | in stock |
| P-907008106 | 90 | As a main component | 1000 mg |
| P-868578891 | 98 | As a main component | in stock |
| P-580416749 | 95 | As a main component | by resynthesis (? - ? days) |
| P-905336380 | 97 | As a main component | 340 g |
| P-889113929 | 97 | As a main component | 156.2 g |
| P-861982427 | 97 | As a main component | 7.69015 kg |
| P-870656050 | 98 | As a main component | in stock |
| P-505526709 | 95 | As a main component | in stock |
| P-500159377 | 96 | As a main component | in stock |
| P-454417659 | 95 | As a main component | 100 g |
| P-454353202 | 95 | As a main component | 100 mg |
| P-579615021 | 95 | As a main component | in stock |
| P-613276591 | 95 | As a main component | by synthesis |
| P-580512688 | 98 | As a main component | in stock |
| P-1272579678 | 95 | As a main component | 100 g |
| P-852441803 | 95 | As a main component | by synthesis |
| P-1263155627 | 95 | As a main component | by synthesis |
| P-500382771 | 98 | As a main component | by synthesis |
| P-885544958 | 95 | As a main component | by synthesis |
| P-502329485 | 90 | As a main component | in stock |
| P-906903846 | 98 | As a main component | in stock |
| P-611461757 | 90 | As a main component | in stock |
| P-611387320 | 90 | As a main component | in stock |
| P-615646718 | 95 | As a main component | unavailable |
| P-1271594687 | 97 | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 110.118 |
| logP | 0.4247 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 1 |
| PSA | 67.69 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 29.7871 |
| Atoms | 14 |
| Rings | 1 |
| Heavy atoms | 8 |
| 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 | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 1 |

