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MCULE-6461288386
Compound
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- InChI:
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1
MCULE-1134528621
- Component type: Main
-
1
MCULE-2361956978
- Component type: Counter Ion
| Name | File |
|---|---|
| SDF | MCULE-6461288386.sdf |
| SMILES | MCULE-6461288386.smiles |
| Standard InChI | MCULE-6461288386.inchi |
| InChIKey | MCULE-6461288386.txt |
| mcule product ID | Supplier | Catalog | Guaranteed purity (%) | Product matching | Availability |
|---|---|---|---|---|---|
| P-867484939 | A2B Chem | Predominantly Building Block on demand | N/A | Main component | by synthesis |
| Property | Value |
|---|---|
| Components | 2 |
| Mass | 189.920 |
| logP | 2.2529 |
| H-bond acceptors | 0 |
| H-bond donors | 0 |
| Rotatable bonds | 0 |
| PSA | 0.0 |
| RO5 violations | 0 |
| RO3 violations | 0 |
| Refractivity | 13.514 |
| Atoms | 8 |
| Rings | 0 |
| Heavy atoms | 7 |
| Hydrogen atoms | 1 |
| Heteroatoms | 7 |
| N/O atoms | 0 |
| Inorganic atoms | 1 |
| 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 |
