3,3',5-Trichlorobiphenyl
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CAS Number 12674-11-2
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Catalog Number io-1750
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Classification Aryl Halides
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Molecular Weight 257.5000
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SMILES C1=CC(=CC(=C1)Cl)C2=CC(=CC(=C2)Cl)Cl
| Size | QTY | Notes | |
|---|---|---|---|
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No description available for this item
| 1 | AROCLOR 1016 |
| 2 | 3,3',5-TRICHLOROBIPHENYL |
| 3 | 38444-87-0 |
| 4 | Arochlor 1016 |
| 5 | PCB 36 |
| Molecular Formula | C12H7Cl3 |
|---|---|
| Canonical SMILES | C1=CC(=CC(=C1)Cl)C2=CC(=CC(=C2)Cl)Cl |
| Isomeric SMILES | C1=CC(=CC(=C1)Cl)C2=CC(=CC(=C2)Cl)Cl |
| Molecular Weight | 257.5000 |
| InChIKey | RIBGNAJQTOXRDK-UHFFFAOYSA-N |
| InChI | InChI=1S/C12H7Cl3/c13-10-3-1-2-8(4-10)9-5-11(14)7-12(15)6-9/h1-7H |
| XLogP | 5.8000 |
| ExactMass | 255.9613 |
| MonoisotopicMass | 255.9613 |
| TPSA | 0.0000 |
| Complexity | 197.0000 |
| Charge | 0.0000 |
| HBondDonorCount | 0 |
| HBondAcceptorCount | 0 |
| RotatableBondCount | 1 |
| HeavyAtomCount | 15 |
| IsotopeAtomCount | 0 |
| AtomStereoCount | 0 |
| DefinedAtomStereoCount | 0 |
| UndefinedAtomStereoCount | 0 |
| BondStereoCount | 0 |
| DefinedBondStereoCount | 0 |
| UndefinedBondStereoCount | 0 |
| CovalentUnitCount | 1 |
| PatentCount | 16 |
| PatentFamilyCount | 11 |
| LiteratureCount | 154 |
