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UNKNOWN STEREO
MCULE-2098902256
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 | 6 USD | 99 | 20 working days | Get Quote |
| 5 mg | 6 USD | 99 | 20 working days | Get Quote |
| 10 mg | 6 USD | 99 | 20 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-2098902256.sdf |
| SMILES | MCULE-2098902256.smiles |
| Standard InChI | MCULE-2098902256.inchi |
| InChIKey | MCULE-2098902256.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867542538 | 98 | As is | in stock |
| P-875699265 | 98 | As is | in stock |
| P-1265814702 | 98 | As is | in stock |
| P-1275180560 | 98 | As is | in stock |
| P-1275180353 | 98 | As is | in stock |
| P-1275182289 | 98 | As is | in stock |
| P-1275154414 | 95 | As is | in stock |
| P-596938645 | 99 | As is | 500 g |
| P-1271941587 | 98 | As is | 25 g |
| P-864113706 | 99 | As is | in stock |
| P-868544524 | 99 | As is | in stock |
| P-893219563 | 95 | As is | in stock |
| P-893238784 | 95 | As is | in stock |
| P-505494767 | 95 | As is | in stock |
| P-500400399 | 98 | As is | by synthesis |
| P-611493008 | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 349.310 |
| logP | 2.1769 |
| H-bond acceptors | 6 |
| H-bond donors | 1 |
| Rotatable bonds | 5 |
| PSA | 76.72 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 81.1878 |
| Atoms | 39 |
| Rings | 3 |
| Heavy atoms | 25 |
| Hydrogen atoms | 14 |
| Heteroatoms | 9 |
| N/O atoms | 6 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| Chiral centers | 2 |
| R/S chiral centers | 2 |
| 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 |
