1,1 inverted exclamation mark-Ferrocenedicarboxaldehyde
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CAS Number 1271-48-3
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Catalog Number io-406910
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Molecular Weight 244.0700
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SMILES -
| Size | QTY | Notes | |
|---|---|---|---|
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No description available for this item
| 1 | SY071313 |
| 2 | F211528 |
| 3 | 1,1 inverted exclamation mark -Ferrocenedicarboxaldehyde |
| Molecular Formula | C12H12FeO2 |
|---|---|
| Canonical SMILES | - |
| Isomeric SMILES | - |
| Molecular Weight | 244.0700 |
| InChIKey | RKWDVKMCFRUGBJ-UHFFFAOYSA-N |
| InChI | InChI=1S/2C6H6O.Fe/c2*7-5-6-3-1-2-4-6;/h2*1-3,5H,4H2; |
| XLogP | 0.0000 |
| ExactMass | 244.0200 |
| MonoisotopicMass | 244.0200 |
| TPSA | 34.1000 |
| Complexity | 131.0000 |
| Charge | 0.0000 |
| HBondDonorCount | 0 |
| HBondAcceptorCount | 2 |
| RotatableBondCount | 2 |
| HeavyAtomCount | 15 |
| IsotopeAtomCount | 0 |
| AtomStereoCount | 0 |
| DefinedAtomStereoCount | 0 |
| UndefinedAtomStereoCount | 0 |
| BondStereoCount | 0 |
| DefinedBondStereoCount | 0 |
| UndefinedBondStereoCount | 0 |
| CovalentUnitCount | 3 |
| PatentCount | 0 |
| PatentFamilyCount | 0 |
| LiteratureCount | 0 |
