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MCULE-9400936063
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 | 103 USD | 90 | 22 working days | Get Quote |
| 5 mg | 149 USD | 90 | 22 working days | Get Quote |
| 10 mg | 206 USD | 90 | 22 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-9400936063.sdf |
| SMILES | MCULE-9400936063.smiles |
| Standard InChI | MCULE-9400936063.inchi |
| InChIKey | MCULE-9400936063.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-903467110 | Aaron Chemicals LLC | Predominantly Building Block | 95 | As is | 1000 mg |
| P-6253668 | ChemBridge | EXPRESS-Pick Collection | 90 | As is | 10 mg |
| P-896083526 | Specs | Repurposed Compounds | N/A | As is | 56 mg |
| P-902567631 | Specs | Natural Products | 80 | As is | 56 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 288.269 |
| logP | 2.7949 |
| H-bond acceptors | 4 |
| H-bond donors | 0 |
| Rotatable bonds | 6 |
| PSA | 52.6 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 74.2655 |
| Atoms | 34 |
| Rings | 2 |
| Heavy atoms | 21 |
| Hydrogen atoms | 13 |
| Heteroatoms | 5 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 1 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| 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 |
