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MCULE-2063859055
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 | 17 USD | 95 | 14 working days | Get Quote |
| 5 mg | 17 USD | 95 | 14 working days | Get Quote |
| 10 mg | 43 USD | 95 | 20 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-2063859055.sdf |
| SMILES | MCULE-2063859055.smiles |
| Standard InChI | MCULE-2063859055.inchi |
| InChIKey | MCULE-2063859055.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-903052573 | 95 | As is | 2 g |
| P-590942926 | 95 | As is | by synthesis |
| P-905263442 | 95 | As is | in stock |
| P-895226788 | 95 | As is | in stock |
| P-1266027720 | 95 | As an isomer | in stock |
| P-904638926 | 95 | As an isomer | by resynthesis (? - ? days) |
| P-893594554 | 90 | As an isomer | 2 g |
| P-596928420 | 95 | As an isomer | 2 g |
| P-494342355 | 95 | As an isomer | by resynthesis (? - ? days) |
| P-864152292 | 95 | As an isomer | in stock |
| P-893228682 | 95 | As an isomer | in stock |
| P-851305993 | 95 | As an isomer | by synthesis |
| P-1273142750 | 95 | As an isomer | 2 g |
| P-855984764 | 97 | As an isomer | 1.027 g |
| P-888881427 | N/A | As an isomer | in stock |
| P-906907091 | 95 | As an isomer | in stock |
| P-1271549751 | 95 | As an isomer | by synthesis |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 212.243 |
| logP | 3.2682 |
| H-bond acceptors | 2 |
| H-bond donors | 2 |
| Rotatable bonds | 2 |
| PSA | 40.46 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 65.858 |
| Atoms | 28 |
| Rings | 2 |
| Heavy atoms | 16 |
| Hydrogen atoms | 12 |
| Heteroatoms | 2 |
| N/O atoms | 2 |
| 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 | 1 |
| Cis/trans stereo double bonds | 1 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
