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MCULE-9976402631-1
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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 | 18 USD | 98 | 19 working days | Get Quote |
| 5 mg | 18 USD | 98 | 19 working days | Get Quote |
| 10 mg | 18 USD | 98 | 19 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-9976402631-1.sdf |
| SMILES | MCULE-9976402631-1.smiles |
| Standard InChI | MCULE-9976402631-1.inchi |
| InChIKey | MCULE-9976402631-1.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-869189683 | AK Scientific | Building Blocks | 98 | As is | in stock |
| P-505393932 | AK Scientific | Building Blocks | 99 | As is | in stock |
| P-895937263 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-579791285 | Apollo Scientific | In Stock | 95 | As is | unavailable |
| P-579791286 | Apollo Scientific | In Stock | 95 | As is | unavailable |
| P-579791288 | Apollo Scientific | In Stock | 95 | As is | unavailable |
| P-579791287 | Apollo Scientific | In Stock | 95 | As is | unavailable |
| P-893247739 | Biosynth | Synthesis | 95 | As is | by synthesis |
| P-608220977 | Glentham Life Sciences | Compounds maintained in stock | 99 | As is | in stock |
| P-500418249 | Glentham Life Sciences | Compounds maintained in stock | 99 | As is | in stock |
| P-580093576 | Iris Biotech GmbH | Building Block Library | N/A | As is | in stock |
| P-579616689 | LabSeeker, Inc | Stock Collection | 98 | As is | in stock |
| P-601067469 | Life Chemicals | Screening Compounds | 90 | As is | in stock |
| P-601099921 | Life Chemicals | Building Blocks | 95 | As is | in stock |
| P-580510526 | Manchester Organics | Stock compounds | 98 | As is | 332 g |
| P-26433576 | Otava | In-House Stock Library | 90 | As is | 5 g |
| P-492279888 | Otava | Chemical Building Blocks for Prompt Delivery | 90 | As is | 5 g |
| P-885550881 | Princeton Biomolecular Research | Building Blocks Synthesis | 95 | As is | by synthesis |
| P-855254176 | Toronto Research | In stock | 90 | As is | in stock |
| P-854994159 | Toronto Research | In stock | 90 | As is | in stock |
| P-868492477 | eNovation Chemicals LLC | Building Blocks in stock | 95 | As is | in stock |
| P-590369998 | AK Scientific | Building Blocks | 98 | As a component | in stock |
| P-489135299 | Amadis Chemical Company Limited | Amadis Chemical General Catalog | 97 | As a component | in stock |
| P-596565076 | Key Organics | Building Blocks | 97 | As a component | 25 g |
| P-580517003 | Manchester Organics | Stock compounds | 97 | As a component | 2.373 kg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 114.023 |
| logP | 0.6333 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 1 |
| PSA | 37.3 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 13.6908 |
| Atoms | 8 |
| Rings | 0 |
| Heavy atoms | 7 |
| Hydrogen atoms | 1 |
| Heteroatoms | 5 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 3 |
| Chiral centers | 0 |
| R/S chiral centers | 0 |
| 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 |
