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UNKNOWN STEREO
MCULE-2705745406
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 | 16 USD | 96 | 20 working days | Get Quote |
| 5 mg | 16 USD | 96 | 20 working days | Get Quote |
| 10 mg | 16 USD | 96 | 20 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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| Name | File |
|---|---|
| SDF | MCULE-2705745406.sdf |
| SMILES | MCULE-2705745406.smiles |
| Standard InChI | MCULE-2705745406.inchi |
| InChIKey | MCULE-2705745406.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867634325 | 96 | As is | in stock |
| P-875798946 | N/A | As is | in stock |
| P-590399482 | 98 | As is | in stock |
| P-606872188 | N/A | As is | in stock |
| P-596967156 | 96 | As is | 50 g |
| P-864154301 | 99 | As is | in stock |
| P-893232074 | 95 | As is | in stock |
| P-675217014 | 95 | As is | in stock |
| P-869121508 | 95 | As is | by synthesis |
| P-892289826 | 95 | As is | unavailable |
| P-888636141 | 95 | As is | 4.853 g |
| P-611416759 | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 206.280 |
| logP | 3.0732 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 4 |
| PSA | 37.3 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 62.1808 |
| Atoms | 33 |
| Rings | 1 |
| Heavy atoms | 15 |
| Hydrogen atoms | 18 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| 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 |
