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MCULE-7235431198
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 | 13 USD | 98 | 9 working days | Get Quote |
| 5 mg | 13 USD | 98 | 9 working days | Get Quote |
| 10 mg | 13 USD | 98 | 9 working days | Get Quote |
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MCULE-4895067742
- Component type: Main
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MCULE-2849116379
- Component type: Main
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MCULE-3202715620
- Component type: Main
| Name | File |
|---|---|
| SDF | MCULE-7235431198.sdf |
| SMILES | MCULE-7235431198.smiles |
| Standard InChI | MCULE-7235431198.inchi |
| InChIKey | MCULE-7235431198.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-905587294 | 98 | As is | by synthesis |
| P-895181486 | 95 | As is | in stock |
| P-666964096 | 97 | As a main component | 25 g |
| P-893635710 | 95 | As a main component | by synthesis |
| P-868595445 | 98 | As a main component | in stock |
| P-620945743 | 98 | As a main component | in stock |
| P-1264054781 | 35 | As an isomer | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 256.104 |
| logP | -1.8561 |
| H-bond acceptors | 9 |
| H-bond donors | 5 |
| Rotatable bonds | 4 |
| PSA | 163.56 |
| RO5 violations | 0 |
| RO3 violations | 4 |
| Refractivity | 45.6205 |
| Atoms | 25 |
| Rings | 1 |
| Heavy atoms | 16 |
| Hydrogen atoms | 9 |
| Heteroatoms | 10 |
| N/O atoms | 9 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 2 |
| R/S chiral centers | 2 |
| 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 |
