Fluenetil
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CAS Number 4301-50-2
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Catalog Number io-2401
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Classification Esters
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Molecular Weight 258.2900
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SMILES C1=CC=C(C=C1)C2=CC=C(C=C2)CC(=O)OCCF
| Size | QTY | Notes | |
|---|---|---|---|
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Fluenetil is a member of biphenyls.
| 1 | FLUENETIL |
| 2 | Fluenethyl |
| 3 | Mytrol |
| 4 | Lambrol |
| 5 | Fluenetil [ISO] |
| Molecular Formula | C16H15FO2 |
|---|---|
| Canonical SMILES | C1=CC=C(C=C1)C2=CC=C(C=C2)CC(=O)OCCF |
| Isomeric SMILES | C1=CC=C(C=C1)C2=CC=C(C=C2)CC(=O)OCCF |
| Molecular Weight | 258.2900 |
| InChIKey | XAERLJMOUYEBAB-UHFFFAOYSA-N |
| InChI | InChI=1S/C16H15FO2/c17-10-11-19-16(18)12-13-6-8-15(9-7-13)14-4-2-1-3-5-14/h1-9H,10-12H2 |
| XLogP | 3.9000 |
| ExactMass | 258.1056 |
| MonoisotopicMass | 258.1056 |
| TPSA | 26.3000 |
| Complexity | 266.0000 |
| Charge | 0.0000 |
| HBondDonorCount | 0 |
| HBondAcceptorCount | 3 |
| RotatableBondCount | 6 |
| HeavyAtomCount | 19 |
| IsotopeAtomCount | 0 |
| AtomStereoCount | 0 |
| DefinedAtomStereoCount | 0 |
| UndefinedAtomStereoCount | 0 |
| BondStereoCount | 0 |
| DefinedBondStereoCount | 0 |
| UndefinedBondStereoCount | 0 |
| CovalentUnitCount | 1 |
| PatentCount | 3223 |
| PatentFamilyCount | 647 |
| LiteratureCount | 7 |
