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MCULE-6971198355-0
Structure
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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 | 109 USD | 90 | 20 working days | Get Quote |
| 5 mg | 109 USD | 90 | 20 working days | Get Quote |
| 10 mg | 109 USD | 90 | 20 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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1
MCULE-8251830457-1
- Component type: Main
-
1
MCULE-5142506228-0
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-6971198355-0.sdf |
| SMILES | MCULE-6971198355-0.smiles |
| Standard InChI | MCULE-6971198355-0.inchi |
| InChIKey | MCULE-6971198355-0.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-31273474 | LaboTest | Screening Collection | 90 | As is | 10 g |
| P-856039508 | LaboTest | Building Blocks | 90 | As is | 10 g |
| P-31273472 | LaboTest | Screening Collection | 90 | Main component as a main component | 10 g |
| P-856039476 | LaboTest | Building Blocks | 90 | Main component as a main component | 10 g |
| P-502367901 | TimTec | Building Block Collection | 90 | Main component as a main component | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 137.099 |
| logP | -0.8986 |
| H-bond acceptors | 8 |
| H-bond donors | 4 |
| Rotatable bonds | 1 |
| PSA | 158.42 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 32.5149 |
| Atoms | 16 |
| Rings | 0 |
| Heavy atoms | 9 |
| Hydrogen atoms | 7 |
| Heteroatoms | 8 |
| N/O atoms | 8 |
| 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 | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
