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MCULE-1174934902
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 | 71 USD | 90 | 10 working days | Get Quote |
| 5 mg | 88 USD | 90 | 10 working days | Get Quote |
| 10 mg | 119 USD | 90 | 10 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-1174934902.sdf |
| SMILES | MCULE-1174934902.smiles |
| Standard InChI | MCULE-1174934902.inchi |
| InChIKey | MCULE-1174934902.txt |
| mcule product ID | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|
| P-892923922 | N/A | As is | by synthesis |
| P-870576753 | 95 | As is | by synthesis |
| P-893294490 | 90 | As is | 2.545 g |
| P-596586000 | 90 | As is | 5 g |
| P-869130445 | 95 | As is | by synthesis |
| P-888642188 | 95 | As is | unavailable |
| P-33220537 | 90 | As is | in stock |
| P-611579378 | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 1 |
| Mass | 179.172 |
| logP | 1.1439 |
| H-bond acceptors | 4 |
| H-bond donors | 2 |
| Rotatable bonds | 3 |
| PSA | 69.89 |
| RO5 violations | 0 |
| RO3 violations | 2 |
| Refractivity | 47.2083 |
| Atoms | 22 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 9 |
| Heteroatoms | 4 |
| N/O atoms | 4 |
| 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 | 1 |
| Cis/trans stereo double bonds | 0 |
| Unknown stereo double bonds | 1 |
| Undefined stereo double bonds | 0 |
