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MCULE-3747426993
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 | 82 USD | 95 | 15 working days | Get Quote |
| 5 mg | 82 USD | 95 | 15 working days | Get Quote |
| 10 mg | 82 USD | 95 | 15 working days | Get Quote |
New customers are eligible for a 10% discount if indicated at the time of ordering.
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1
MCULE-4684386765
- Component type: Unknown
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1
MCULE-6475627950
- Component type: Unknown
| Name | File |
|---|---|
| SDF | MCULE-3747426993.sdf |
| SMILES | MCULE-3747426993.smiles |
| Standard InChI | MCULE-3747426993.inchi |
| InChIKey | MCULE-3747426993.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-612939515 | AK Scientific | Building Blocks | 95 | As is | in stock |
| P-494308629 | Apollo Scientific | On request | 95 | As is | by resynthesis (? - ? days) |
| P-502404529 | TimTec | Building Block Collection | 90 | As is | in stock |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 233.093 |
| logP | 3.5316 |
| H-bond acceptors | 2 |
| H-bond donors | 1 |
| Rotatable bonds | 0 |
| PSA | 39.43 |
| RO5 violations | 0 |
| RO3 violations | 1 |
| Refractivity | 41.5604 |
| Atoms | 23 |
| Rings | 1 |
| Heavy atoms | 13 |
| Hydrogen atoms | 10 |
| Heteroatoms | 9 |
| N/O atoms | 2 |
| Inorganic atoms | 0 |
| Halogen atoms | 6 |
| 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 |
