2-(trans-4-Pentylcyclohexyl)-1,3-propanediol
[CAS# 93129-37-4]

Identification

• Name: 2-(trans-4-Pentylcyclohexyl)-1,3-propanediol
• Synonyms: 2-(4-pentylcyclohexyl)propane-1,3-diol
• Molecular Formula: C₁₄H₂₈O₂
• Molecular Weight: 228.37
• CAS Registry Number: 93129-37-4
• SMILES: CCCCC[C@H]1CC[C@@H](CC1)C(CO)CO
• InChI: 1S/C14H28O2/c1-2-3-4-5-12-6-8-13(9-7-12)14(10-15)11-16/h12-16H,2-11H2,1H3/t12-,13-
• InChIKey: LLWMASNUGKCKMQ-JOCQHMNTSA-N

Properties

• Density: 0.949g/cm³ (Cal.)
• Boiling point: 356.428°C at 760 mmHg (Cal.)
• Flash point: 161.437°C (Cal.)