3-(Methylthio)hexanal

• CAS: 38433-74-8
• Catalog Number: ACM38433748
• Category: Other Products
• Molecular Weight: 146.25
• Molecular Formula: C₇H₁₄OS
• Synonyms: FEMA 3877;3-(METHYLTHIO) HEXANAL
• Canonical SMILES: CCCC(CC=O)SC
• InChI: InChI=1S/C7H14OS/c1-3-4-7(9-2)5-6-8/h6-7H,3-5H2,1-2H3
• InChI Key: VIVJHDGDCOQORO-UHFFFAOYSA-N
• Boiling Point: 206.3±23.0 °C
• Density: 0.939±0.06 g/cm³
• Solubility: Insoluble in water; soluble in ethanol, triacetin and heptane
• Exact Mass: 146.07653624
• Monoisotopic Mass: 146.07653624
• Physical State: Liquid
• Refractive Index: n20/D 1.475-1.485(lit.)
• Topological Polar Surface Area: 42.4 Ų