(1R,2S)-2-Hexyl-3-Oxocyclopentane-1-Carboxylic Acid
[CAS# 37172-52-4]

Identification

• Name: (1R,2S)-2-Hexyl-3-Oxocyclopentane-1-Carboxylic Acid
• Synonyms: (1R,2S)-2-Hexyl-3-Oxo-Cyclopentane-1-Carboxylic Acid; (1R,2S)-2-Hexyl-3-Oxo-1-Cyclopentanecarboxylic Acid; (1R,2S)-2-Hexyl-3-Keto-Cyclopentane-1-Carboxylic Acid
• Molecular Formula: C₁₂H₂₀O₃
• Molecular Weight: 212.29
• CAS Registry Number: 37172-52-4
• SMILES: [C@H]1(C(=O)O)[C@@H](C(=O)CC1)CCCCCC
• InChI: 1S/C12H20O3/c1-2-3-4-5-6-9-10(12(14)15)7-8-11(9)13/h9-10H,2-8H2,1H3,(H,14,15)/t9-,10+/m0/s1
• InChIKey: DJAOIPLLYKPHJI-VHSXEESVSA-N

Properties

• Density: 1.056g/cm³ (Cal.)
• Boiling point: 355.368°C at 760 mmHg (Cal.)
• Flash point: 182.912°C (Cal.)