(1S,2S,4R)-2-Isopropyl-1,4-Cyclohexanediol
[CAS# 179249-41-3]

Identification

• Name: (1S,2S,4R)-2-Isopropyl-1,4-Cyclohexanediol
• Synonyms: (1S,2S,4R)-2-isopropylcyclohexane-1,4-diol
• Molecular Formula: C₉H₁₈O₂
• Molecular Weight: 158.24
• CAS Registry Number: 179249-41-3
• SMILES: O[C@@H]1[C@H](C(C)C)C[C@H](O)CC1
• InChI: 1S/C9H18O2/c1-6(2)8-5-7(10)3-4-9(8)11/h6-11H,3-5H2,1-2H3/t7-,8+,9+/m1/s1
• InChIKey: XSEWIIKMVMWAKL-VGMNWLOBSA-N

Properties

• Density: 1.037g/cm³ (Cal.)
• Boiling point: 267.12°C at 760 mmHg (Cal.)
• Flash point: 123.752°C (Cal.)
• Refractive index: 1.498 (Cal.)