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| IUPAC Name: | propane-1,3-dithiol |
| Description: | 1,3-Propanedithiol (CAS# 109-80-8) is a dithiol that is a useful reagent in synthetic preparations. It is widely used for protection of carbonyl containing compounds. 1,3-Propanedithiol is also used in the synthesis of aminoalkynyldithianes calcium channel blockers. |
| Molecular Weight: | 108.23 |
| Molecular Formula: | C3H8S2 |
| Canonical SMILES: | C(CS)CS |
| InChI: | InChI=1S/C3H8S2/c4-2-1-3-5/h4-5H,1-3H2 |
| InChI Key: | ZJLMKPKYJBQJNH-UHFFFAOYSA-N |
| Boiling Point: | 170 °C |
| Melting Point: | -79 °C |
| Flash Point: | 61 °C |
| Purity: | 99 % |
| Density: | 1.078 g/mL at 25 °C (lit.) |
| Solubility: | less than 1 mg/mL at 70 °F |
| Appearance: | Colorless to light yellow to light orange clear liquid |
| MDL: | MFCD00004904 |
| LogP: | 1.23610 |
| Refractive Index: | 1.539 (lit.) |
| Vapor Pressure: | 16.3 mmHg at 28 °F ; 22.8 mmHg at 77 °F; 34.6 mmHg at 108 °F |
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