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UNKNOWN STEREO
MCULE-2890516597
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 | 7 USD | 98 | 20 working days | Get Quote |
| 5 mg | 7 USD | 98 | 20 working days | Get Quote |
| 10 mg | 7 USD | 98 | 20 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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MCULE-3907715932
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-2890516597.sdf |
| SMILES | MCULE-2890516597.smiles |
| Standard InChI | MCULE-2890516597.inchi |
| InChIKey | MCULE-2890516597.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867587385 | 97 | As is | in stock |
| P-875746390 | N/A | As is | in stock |
| P-869190232 | 95 | As is | in stock |
| P-505388789 | 98 | As is | in stock |
| P-580237158 | 95 | As is | by synthesis |
| P-606898667 | N/A | As is | in stock |
| P-596954868 | 98 | As is | 25 kg |
| P-864085274 | 97 | As is | in stock |
| P-893234897 | 95 | As is | in stock |
| P-675211560 | 95 | As is | in stock |
| P-594273699 | 95 | As is | by synthesis |
| P-869177216 | 95 | As is | in stock |
| P-892295306 | 95 | As is | unavailable |
| P-892337705 | 95 | As is | 202 mg |
| P-611442567 | 90 | As is | in stock |
| P-615391803 | 95 | As is | in stock |
| P-893140538 | N/A | As a main component | by synthesis |
| P-851858459 | N/A | As a main component | by synthesis |
| P-864213572 | 95 | As a main component | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 117.146 |
| logP | 0.8987 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 63.32 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 30.6282 |
| Atoms | 19 |
| Rings | 0 |
| Heavy atoms | 8 |
| Hydrogen atoms | 11 |
| Heteroatoms | 3 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |
