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UNKNOWN STEREO
MCULE-9765473112
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 | 39 USD | 95 | 11 working days | Get Quote |
| 5 mg | 77 USD | N/A | 10 working days | Get Quote |
| 10 mg | 143 USD | 95 | 19 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-9765473112.sdf |
| SMILES | MCULE-9765473112.smiles |
| Standard InChI | MCULE-9765473112.inchi |
| InChIKey | MCULE-9765473112.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867584610 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875742739 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-505389988 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-580234790 | Aldlab Chemicals | Building Block Custom Synth | 95 | As is | by synthesis |
| P-872943074 | AmBeed | In stock | N/A | As is | in stock |
| P-881654567 | Apexbio Technology | Bioactive Compound Library | 98 | As is | in stock |
| P-864132200 | AstaTech | In Stock BBs | 95 | As is | in stock |
| P-675219671 | Hangzhou Apichem | Building Blocks in stock | 95 | As is | in stock |
| P-500409215 | Pi Chemicals | Virtual Compounds | 95 | As is | by synthesis |
| P-869177035 | TargetMol | Natural Products | 95 | As is | 581 mg |
| P-611421962 | Toronto Research | In stock | 90 | As is | in stock |
| P-480860320 | eNovation Chemicals LLC | Building Blocks in stock | 98 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 363.366 |
| logP | 2.243 |
| H-bond acceptors | 7 |
| H-bond donors | 2 |
| Rotatable bonds | 1 |
| PSA | 107.44 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 99.7192 |
| Atoms | 44 |
| Rings | 5 |
| Heavy atoms | 27 |
| Hydrogen atoms | 17 |
| Heteroatoms | 7 |
| N/O atoms | 7 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| Chiral centers | 1 |
| R/S chiral centers | 1 |
| 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 |
