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| IUPAC Name: | (E)-hex-3-enoic acid |
| Description: | trans-3-Hexenoic acid (CAS# 1577-18-0) is a useful organic reagent. It was used to design optically active selenium reagents with a chiral tertiary amino groups. It is a side-chain for penicillin F (CAS# 118-53-6). |
| Molecular Weight: | 114.14 |
| Molecular Formula: | C6H10O2 |
| Canonical SMILES: | CCC=CCC(=O)O |
| InChI: | InChI=1S/C6H10O2/c1-2-3-4-5-6(7)8/h3-4H,2,5H2,1H3,(H,7,8)/b4-3+ |
| InChI Key: | XXHDAWYDNSXJQM-ONEGZZNKSA-N |
| Boiling Point: | 208.00 °C (EPI 4.0) |
| Purity: | 96.0 % |
| Density: | 0.965 g/cm3 |
| Solubility: | Insoluble in water; soluble in alcohol. |
| Appearance: | Colorless to pale yellow liquid |
| Storage: | Store tightly sealed under inert gas in a cool, well-ventilated area. |
| MDL: | MFCD00002786 |
| LogP: | 1.42730 |
| Refractive Index: | 1.436 : 1.443 at 20 deg C |
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