(1R,2R,3S)-2-Ethynyl-2-Methyl-1,3-Cyclopentanediol
[CAS# 138768-04-4]

Identification

• Name: (1R,2R,3S)-2-Ethynyl-2-Methyl-1,3-Cyclopentanediol
• Synonyms: (1R,2r,3S)-2-ethynyl-2-methylcyclopentane-1,3-diol
• Molecular Formula: C₈H₁₂O₂
• Molecular Weight: 140.18
• CAS Registry Number: 138768-04-4
• SMILES: C[C@@]1([C@@H](CC[C@@H]1O)O)C#C
• InChI: 1S/C8H12O2/c1-3-8(2)6(9)4-5-7(8)10/h1,6-7,9-10H,4-5H2,2H3/t6-,7+,8+
• InChIKey: KASVPOCEQOFTOB-JIGDXULJSA-N

Properties

• Density: 1.131g/cm³ (Cal.)
• Boiling point: 228.819°C at 760 mmHg (Cal.)
• Flash point: 104.428°C (Cal.)
• Refractive index: 1.523 (Cal.)