Octahydro-2H-1-benzopyran-2-one

• CAS: 4430-31-3
• Catalog Number: ACM4430313
• Category: Other Products
• Molecular Weight: 154.21
• Molecular Formula: C9H14O2
• Synonyms: Octahydrocoumarin
• IUPAC Name: 3,4,4a,5,6,7,8,8a-Octahydrochromen-2-one
• Canonical SMILES: C1CCC2C(C1)CCC(=O)O2
• InChI: InChI=1S/C9H14O2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h7-8H,1-6H2
• InChI Key: MSFLYJIWLHSQLG-UHFFFAOYSA-N
• Boiling Point: 145 °C
• Flash Point: >230 °F
• Density: 1.092 g/mL at 25 °C(lit.)
• Solubility: Insoluble in water; soluble in oils
• Exact Mass: 154.099379685
• Monoisotopic Mass: 154.099379685
• Physical State: Liquid
• Refractive Index: n20/D 1.492(lit.)
• Storage Conditions: 2-8 °C
• Topological Polar Surface Area: 26.3 Ų