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MCULE-2708504544
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 | 95 | 8 working days | Get Quote |
| 5 mg | 20 USD | 98 | 16 working days | Get Quote |
| 10 mg | 30 USD | 98 | 16 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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MCULE-9496472579
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-2708504544.sdf |
| SMILES | MCULE-2708504544.smiles |
| Standard InChI | MCULE-2708504544.inchi |
| InChIKey | MCULE-2708504544.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-590969571 | 97 | As is | by synthesis |
| P-895173402 | 95 | As is | by synthesis |
| P-903090249 | 98 | As a main component | 1.25 g |
| P-893618635 | 90 | As a main component | 20.706 g |
| P-860056702 | 98 | As a main component | by synthesis |
| P-590605655 | 95 | As a main component | 1.15 g |
| P-871219952 | N/A | As a main component | by resynthesis (? - ? days) |
| P-896543811 | 97 | As a main component | in stock |
| P-872749047 | 97 | As a main component | in stock |
| P-852460767 | N/A | As a main component | in stock |
| P-865621217 | 95 | As a main component | in stock |
| P-896631026 | 95 | As a main component | in stock |
| P-584625262 | 95 | As a main component | in stock |
| P-619673716 | 98 | As a main component | in stock |
| P-1263958189 | 90 | As a main component | in stock |
| P-617405043 | N/A | As a main component | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 241.248 |
| logP | -0.843 |
| H-bond acceptors | 8 |
| H-bond donors | 6 |
| Rotatable bonds | 2 |
| PSA | 136.29 |
| RO5 violations | 1 |
| RO3 violations | 3 |
| Refractivity | 68.3741 |
| Atoms | 32 |
| Rings | 2 |
| Heavy atoms | 17 |
| Hydrogen atoms | 15 |
| Heteroatoms | 8 |
| N/O atoms | 8 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 3 |
| R/S chiral centers | 3 |
| 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 |
