2,4-Dichlorophenyl benzenesulfonate
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CAS Number 97-16-5
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Catalog Number io-406813
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Molecular Weight 303.2000
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SMILES C1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)Cl)Cl
| Size | QTY | Notes | |
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No description available for this item
| 1 | Genite |
| 2 | 2,4-DICHLOROPHENYL BENZENESULFONATE |
| 3 | Genitol |
| 4 | DPBS |
| 5 | Genitol 923 |
| Molecular Formula | C12H8Cl2O3S |
|---|---|
| Canonical SMILES | C1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)Cl)Cl |
| Isomeric SMILES | C1=CC=C(C=C1)S(=O)(=O)OC2=C(C=C(C=C2)Cl)Cl |
| Molecular Weight | 303.2000 |
| InChIKey | OZFAFGSSMRRTDW-UHFFFAOYSA-N |
| InChI | InChI=1S/C12H8Cl2O3S/c13-9-6-7-12(11(14)8-9)17-18(15,16)10-4-2-1-3-5-10/h1-8H |
| XLogP | 4.3000 |
| ExactMass | 301.9571 |
| MonoisotopicMass | 301.9571 |
| TPSA | 51.8000 |
| Complexity | 360.0000 |
| Charge | 0.0000 |
| HBondDonorCount | 0 |
| HBondAcceptorCount | 3 |
| RotatableBondCount | 3 |
| HeavyAtomCount | 18 |
| IsotopeAtomCount | 0 |
| AtomStereoCount | 0 |
| DefinedAtomStereoCount | 0 |
| UndefinedAtomStereoCount | 0 |
| BondStereoCount | 0 |
| DefinedBondStereoCount | 0 |
| UndefinedBondStereoCount | 0 |
| CovalentUnitCount | 1 |
| PatentCount | 29552 |
| PatentFamilyCount | 8416 |
| LiteratureCount | 203 |
