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MCULE-1231583021
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 | 10 USD | 98 | 14 working days | Get Quote |
| 5 mg | 10 USD | 98 | 14 working days | Get Quote |
| 10 mg | 10 USD | 98 | 14 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-1231583021.sdf |
| SMILES | MCULE-1231583021.smiles |
| Standard InChI | MCULE-1231583021.inchi |
| InChIKey | MCULE-1231583021.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-903204908 | 98 | As is | 20 g |
| P-580701964 | 97 | As is | 7.45 g |
| P-452659775 | 98 | As is | in stock |
| P-851241018 | 95 | As is | by synthesis |
| P-905265361 | 97 | As is | in stock |
| P-579480282 | 95 | As is | in stock |
| P-861987843 | 98 | As is | 3.791 g |
| P-1273117237 | 98 | As is | 5 g |
| P-579617094 | 97 | As is | in stock |
| P-1272581799 | 95 | As is | 2 g |
| P-852444581 | 95 | As is | by synthesis |
| P-1263158664 | 95 | As is | in stock |
| P-854691070 | 95 | As is | in stock |
| P-872672849 | 95 | As is | in stock |
| P-878640189 | 98 | As is | in stock |
| P-579710956 | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 242.269 |
| logP | 2.8165 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 1 |
| PSA | 49.69 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 69.126 |
| Atoms | 32 |
| Rings | 3 |
| Heavy atoms | 18 |
| Hydrogen atoms | 14 |
| 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 |
