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| | 1-Naphthalenesulfonyl chloride Basic information |
| | 1-Naphthalenesulfonyl chloride Chemical Properties |
| Melting point | 64-67 °C (lit.) | | Boiling point | 194-195 °C/13 mmHg (lit.) | | density | 1.3661 (estimate) | | Fp | 194-195°C/13mm | | storage temp. | Inert atmosphere,Room Temperature | | solubility | chloroform: soluble25mg/mL, clear to very slightly hazy, colorless to yellow | | form | powder to crystal | | color | White to Almost white | | Water Solubility | insoluble | | Sensitive | Moisture Sensitive | | BRN | 2099333 | | InChI | 1S/C10H7ClO2S/c11-14(12,13)10-7-3-5-8-4-1-2-6-9(8)10/h1-7H | | InChIKey | DASJFYAPNPUBGG-UHFFFAOYSA-N | | SMILES | ClS(=O)(=O)c1cccc2ccccc12 | | CAS DataBase Reference | 85-46-1(CAS DataBase Reference) | | NIST Chemistry Reference | 1-Naphthalenesulfonyl chlorine(85-46-1) | | EPA Substance Registry System | 1-Naphthalenesulfonyl chloride (85-46-1) |
| Hazard Codes | C | | Risk Statements | 34 | | Safety Statements | 26-36/37/39-45-27 | | RIDADR | UN 3261 8/PG 2 | | WGK Germany | 3 | | F | 10-21 | | Hazard Note | Corrosive | | TSCA | TSCA listed | | HazardClass | 8 | | PackingGroup | II | | HS Code | 29049090 | | Storage Class | 8A - Combustible corrosive hazardous materials | | Hazard Classifications | Eye Dam. 1
Skin Corr. 1B |
| | 1-Naphthalenesulfonyl chloride Usage And Synthesis |
| Chemical Properties | white to beige crystalline powder | | Uses | 1-Naphthalenesulfonyl chloride has been used in the preparation of 5-O-naphthaleneiulfonyldeoxyuridine and 1-sulfonylindazole derivatives. The derivatives of this compound is used for quantitative metabolome analysis New set of isotope reagents, 12C4-, 12C213C2-, and 13C4-5-diethylamino-naphthalene-1-sulfonyl chloride (DensCl), in combination with liquid chromatography Fourier-transform ion cyclotron resonance mass spectrometry (LC-FTICR-MS) is used for improved analysis of the amine- and phenol-containing submetabolome. | | General Description | 1-Naphthalenesulfonyl chloride undergoes desulfitative carbonylative Stille cross-coupling reaction with tinglucal derivative. | | Purification Methods | If the IR indicates the presence of OH, then treat it with an equal weight of PCl5 and heat it at ca 100o for 2hours, cool and pour onto ice + H2O, stir well and filter off the solid. Wash the solid with cold H2O and dry the solid in a vacuum desiccator over P2O5 + solid KOH. Extract the solid with pet ether (b 40-60o), filter off any insoluble solid and cool. Collect the crystalline sulfonyl chloride and recrystallise it from dry Et2O, pet ether or *C6H6/pet ether. If large quantities are available, then it can be distilled under high vacuum. [Fierz-Davaid & Weissenbach Helv Chim Acta 3 2312 1920.] The sulfonamide crystallises from EtOH (m 150.5o) or H2O (m 153o). [Beilstein 11 H 175, 11 II 93, 11 IV 383.] |
| | 1-Naphthalenesulfonyl chloride Preparation Products And Raw materials |
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