3-[(1S,4R)-4-Ethoxy-2-Oxocyclohexyl]Propanoic Acid
[CAS# 180413-78-9]

Identification

• Name: 3-[(1S,4R)-4-Ethoxy-2-Oxocyclohexyl]Propanoic Acid
• Synonyms: 3-((1S,4R)-4-ethoxy-2-oxocyclohexyl)propanoic acid
• Molecular Formula: C₁₁H₁₈O₄
• Molecular Weight: 214.26
• CAS Registry Number: 180413-78-9
• SMILES: CCO[C@@H]1CC[C@H](C(=O)C1)CCC(=O)O
• InChI: 1S/C11H18O4/c1-2-15-9-5-3-8(10(12)7-9)4-6-11(13)14/h8-9H,2-7H2,1H3,(H,13,14)/t8-,9+/m0/s1
• InChIKey: HTHZXAIDCJAUMF-DTWKUNHWSA-N

Properties

• Density: 1.122g/cm³ (Cal.)
• Boiling point: 370.723°C at 760 mmHg (Cal.)
• Flash point: 141.853°C (Cal.)
• Refractive index: 1.482 (Cal.)