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MCULE-4520943092
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 | 49 USD | 90 | 21 working days | Get Quote |
| 5 mg | 79 USD | 90 | 21 working days | Get Quote |
| 10 mg | 95 USD | 90 | 21 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-4520943092.sdf |
| SMILES | MCULE-4520943092.smiles |
| Standard InChI | MCULE-4520943092.inchi |
| InChIKey | MCULE-4520943092.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-454283235 | 90 | As is | 531.158 g |
| P-596546659 | 90 | As is | 131.852 g |
| P-454384321 | 90 | As is | 531.158 g |
| P-454391619 | 90 | As is | 131.852 g |
| P-563675092 | 95 | As is | 1000 mg |
| P-852451530 | N/A | As is | in stock |
| P-895422169 | 95 | As is | by synthesis |
| P-492274756 | 95 | As is | 2.595 g |
| P-12394213 | 90 | As is | 2.595 g |
| P-502361490 | 90 | As is | in stock |
| P-611604990 | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 219.236 |
| logP | 1.2001 |
| H-bond acceptors | 4 |
| H-bond donors | 1 |
| Rotatable bonds | 3 |
| PSA | 57.61 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 62.1118 |
| Atoms | 29 |
| Rings | 2 |
| Heavy atoms | 16 |
| Hydrogen atoms | 13 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 0 |
| Unknown chiral centers | 0 |
| Undefined chiral centers | 1 |
| Stereo double bonds | 0 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 0 |
| Undefined stereo double bonds | 0 |
