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UNKNOWN STEREO
MCULE-9518968798
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 | 6 USD | N/A | 14 working days | Get Quote |
| 5 mg | 6 USD | N/A | 14 working days | Get Quote |
| 10 mg | 6 USD | N/A | 14 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-9518968798.sdf |
| SMILES | MCULE-9518968798.smiles |
| Standard InChI | MCULE-9518968798.inchi |
| InChIKey | MCULE-9518968798.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-881662382 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-853424923 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-606832912 | AmBeed | In stock | N/A | As is | in stock |
| P-864185849 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-868545510 | Axon Medchem | Axon predominantly SC catalog | 99 | As is | in stock |
| P-856008988 | Key Organics | Biochemicals | 97 | As is | 138 mg |
| P-868498388 | eNovation Chemicals LLC | Building Blocks in stock | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 602.575 |
| logP | 3.28428 |
| H-bond acceptors | 14 |
| H-bond donors | 4 |
| Rotatable bonds | 14 |
| PSA | 213.36 |
| RO5 violations | 2 |
| RO3 violations | 6 |
| Refractivity | 150.4302 |
| Atoms | 77 |
| Rings | 4 |
| Heavy atoms | 42 |
| Hydrogen atoms | 35 |
| Heteroatoms | 15 |
| N/O atoms | 14 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 6 |
| R/S chiral centers | 6 |
| 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 |
