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MCULE-1116177945
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 | 23 USD | 95 | 17 working days | Get Quote |
| 5 mg | 23 USD | 95 | 17 working days | Get Quote |
| 10 mg | 23 USD | 95 | 17 working days | Get Quote |
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| Name | File |
|---|---|
| SDF | MCULE-1116177945.sdf |
| SMILES | MCULE-1116177945.smiles |
| Standard InChI | MCULE-1116177945.inchi |
| InChIKey | MCULE-1116177945.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-489114356 | 97 | As is | in stock |
| P-864304998 | 95 | As is | by synthesis |
| P-901423412 | 95 | As is | by synthesis |
| P-34900109 | 90 | As is | in stock |
| P-502528611 | 95 | As is | by synthesis |
| P-503137255 | 90 | As is | by synthesis |
| P-502670648 | 90 | As is | in stock |
| P-855982456 | 97 | As is | 1000 mg |
| P-31141440 | 90 | As is | 10 g |
| P-1267089437 | 95 | As is | 1.75 g |
| P-666816154 | 95 | As is | 239 mg |
| P-575527763 | 90 | As is | 239 mg |
| P-580468044 | N/A | As is | by synthesis |
| P-885516729 | 95 | As is | by synthesis |
| P-18892818 | 90 | As is | in stock |
| P-502372314 | 90 | As is | in stock |
| P-888431161 | 94 | As is | by resynthesis (? - ? days) |
| P-25571657 | 90 | As is | 92 mg |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 131.202 |
| logP | 1.3066 |
| H-bond acceptors | 3 |
| H-bond donors | 2 |
| Rotatable bonds | 2 |
| PSA | 82.5 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 38.3271 |
| Atoms | 17 |
| Rings | 0 |
| Heavy atoms | 8 |
| Hydrogen atoms | 9 |
| Heteroatoms | 4 |
| N/O atoms | 3 |
| Inorganic atoms | 0 |
| Halogen atoms | 0 |
| 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 |
