Benzimidazole, 4,5-dichloro-2- (trifluoromethyl)-
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CAS Number 3615-21-2
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Catalog Number io-1801
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Classification Amines
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Molecular Weight 255.0200
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SMILES C1=CC(=C(C2=C1NC(=N2)C(F)(F)F)Cl)Cl
| Size | QTY | Notes | |
|---|---|---|---|
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No description available for this item
| 1 | Chlorflurazole |
| 2 | 4,5-Dichloro-2-trifluoromethylbenzimidazole |
| 3 | Chlorflurazole [ISO] |
| 4 | 4,5-Dichloro-2-(trifluoromethyl)-1H-benzimidazole |
| 5 | Benzimidazole, 4,5-dichloro-2-(trifluoromethyl)- |
| Molecular Formula | C8H3Cl2F3N2 |
|---|---|
| Canonical SMILES | C1=CC(=C(C2=C1NC(=N2)C(F)(F)F)Cl)Cl |
| Isomeric SMILES | C1=CC(=C(C2=C1NC(=N2)C(F)(F)F)Cl)Cl |
| Molecular Weight | 255.0200 |
| InChIKey | KSROTSBULDYPKA-UHFFFAOYSA-N |
| InChI | InChI=1S/C8H3Cl2F3N2/c9-3-1-2-4-6(5(3)10)15-7(14-4)8(11,12)13/h1-2H,(H,14,15) |
| XLogP | 3.6000 |
| ExactMass | 253.9625 |
| MonoisotopicMass | 253.9625 |
| TPSA | 28.7000 |
| Complexity | 249.0000 |
| Charge | 0.0000 |
| HBondDonorCount | 1 |
| HBondAcceptorCount | 4 |
| RotatableBondCount | 0 |
| HeavyAtomCount | 15 |
| IsotopeAtomCount | 0 |
| AtomStereoCount | 0 |
| DefinedAtomStereoCount | 0 |
| UndefinedAtomStereoCount | 0 |
| BondStereoCount | 0 |
| DefinedBondStereoCount | 0 |
| UndefinedBondStereoCount | 0 |
| CovalentUnitCount | 1 |
| PatentCount | 2313 |
| PatentFamilyCount | 622 |
| LiteratureCount | 14 |
