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UNKNOWN STEREO
MCULE-5458121764
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 | 5 USD | 95 | 22 working days | Get Quote |
| 5 mg | 7 USD | 95 | 22 working days | Get Quote |
| 10 mg | 7 USD | 95 | 22 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-5458121764.sdf |
| SMILES | MCULE-5458121764.smiles |
| Standard InChI | MCULE-5458121764.inchi |
| InChIKey | MCULE-5458121764.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-893128745 | A2B Chem | Predominantly Building Block on demand | N/A | As is | by synthesis |
| P-867569668 | A2B Chem | Predominantly Building Block in stock | 95 | As is | in stock |
| P-875730096 | AA Blocks | AA Blocks - in stock | N/A | As is | in stock |
| P-579760386 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-856052600 | Aldlab Chemicals | Building Block Custom Synth | 95 | As is | by synthesis |
| P-851416689 | AmBeed | On request | N/A | As is | by synthesis |
| P-606927079 | AmBeed | In stock | N/A | As is | in stock |
| P-851151224 | Angene | Building Blocks in stock | 95 | As is | 2.5668 kg |
| P-864140780 | AstaTech | In Stock BBs | 98 | As is | in stock |
| P-861274514 | Chiralstar | Chiralstar Building Blocks | 95 | As is | in stock |
| P-580405246 | Debye Scientific | General Catalog | 95 | As is | by resynthesis (? - ? days) |
| P-892302677 | TargetMol | Natural Products | 95 | As is | in stock |
| P-869127087 | TargetMol | Screening Compounds - synthesis | 95 | As is | by synthesis |
| P-892291309 | TargetMol | In Stock BB | 95 | As is | unavailable |
| P-888640279 | TargetMol | Screening Compounds - stock amount | 95 | As is | 4.834 g |
| P-502328535 | TimTec | Building Block Collection | 90 | As is | in stock |
| P-988900 | VITAS M CHEMICAL LIMITED | Screening compounds | 90 | As is | 1.971 g |
| P-3216445 | VITAS M CHEMICAL LIMITED | Organic Building Blocks | 90 | As is | 1.971 g |
| P-893946126 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 267.242 |
| logP | -1.0763 |
| H-bond acceptors | 9 |
| H-bond donors | 4 |
| Rotatable bonds | 2 |
| PSA | 139.28 |
| RO5 violations | 0 |
| RO3 violations | 3 |
| Refractivity | 64.3377 |
| Atoms | 32 |
| Rings | 3 |
| Heavy atoms | 19 |
| Hydrogen atoms | 13 |
| Heteroatoms | 9 |
| N/O atoms | 9 |
| 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 |
