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UNKNOWN STEREO
MCULE-1095311163
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 | 9 USD | 98 | 20 working days | Get Quote |
| 5 mg | 9 USD | 98 | 20 working days | Get Quote |
| 10 mg | 9 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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| Name | File |
|---|---|
| SDF | MCULE-1095311163.sdf |
| SMILES | MCULE-1095311163.smiles |
| Standard InChI | MCULE-1095311163.inchi |
| InChIKey | MCULE-1095311163.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-867564992 | 98 | As is | in stock |
| P-875724617 | N/A | As is | in stock |
| P-505354106 | N/A | As is | in stock |
| P-869198076 | 95 | As is | in stock |
| P-596975407 | 98 | As is | 5 kg |
| P-580193693 | 98 | As is | in stock |
| P-864112293 | 97 | As is | in stock |
| P-893260705 | 95 | As is | by synthesis |
| P-893228993 | 95 | As is | in stock |
| P-580450267 | 99 | As is | in stock |
| P-505491571 | 95 | As is | in stock |
| P-488556092 | 92 | As is | in stock |
| P-500374785 | 98 | As is | by synthesis |
| P-611353259 | 90 | As is | in stock |
| P-855287717 | 90 | As is | in stock |
| P-666982575 | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 272.381 |
| logP | 3.6092 |
| H-bond acceptors | 2 |
| H-bond donors | 2 |
| Rotatable bonds | 0 |
| PSA | 40.46 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 81.0268 |
| Atoms | 44 |
| Rings | 4 |
| Heavy atoms | 20 |
| Hydrogen atoms | 24 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 5 |
| R/S chiral centers | 5 |
| 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 |
