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MCULE-4661199945
Compound
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- 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 | 53 USD | 90 | 10 working days | Get Quote |
| 5 mg | 66 USD | 90 | 10 working days | Get Quote |
| 10 mg | 88 USD | 98 | 22 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-4661199945.sdf |
| SMILES | MCULE-4661199945.smiles |
| Standard InChI | MCULE-4661199945.inchi |
| InChIKey | MCULE-4661199945.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-1266153902 | 98 | As is | in stock |
| P-890173206 | 98 | As is | in stock |
| P-894647839 | 95 | As is | by resynthesis (? - ? days) |
| P-1264627436 | 98 | As is | 3 g |
| P-904310853 | 90 | As is | 10.901 g |
| P-1270336572 | 95 | As is | in stock |
| P-851481530 | N/A | As is | by synthesis |
| P-1273279156 | 95 | As is | by resynthesis (? - ? days) |
| P-905464657 | 95 | As is | in stock |
| P-611023505 | 95 | As is | by synthesis |
| P-889037016 | 95 | As is | by synthesis |
| P-905408764 | 98 | As is | 4.901 g |
| P-454398456 | 90 | As is | 3.855 g |
| P-18745479 | 90 | As is | 3.855 g |
| P-895228313 | 95 | As is | in stock |
| P-906887581 | 90 | As is | by synthesis |
| P-1271667064 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 280.346 |
| logP | 4.1907 |
| H-bond acceptors | 3 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 70.23 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 81.5322 |
| Atoms | 32 |
| Rings | 3 |
| Heavy atoms | 20 |
| Hydrogen atoms | 12 |
| Heteroatoms | 4 |
| 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 |
