4-Tert-Butyl-1-Cyclohexen-1-Ol Hexanoate
[CAS# 70288-98-1]

Identification

• Name: 4-Tert-Butyl-1-Cyclohexen-1-Ol Hexanoate
• Synonyms: Hexanoic Acid (4-Tert-Butyl-1-Cyclohexenyl) Ester; 1-Cyclohexen-1-Ol, 4-Tert-Butyl-, Hexanoate
• Molecular Formula: C₁₆H₂₈O₂
• Molecular Weight: 252.40
• CAS Registry Number: 70288-98-1
• SMILES: C(C(OC1=CCC(CC1)C(C)(C)C)=O)CCCC
• InChI: 1S/C16H28O2/c1-5-6-7-8-15(17)18-14-11-9-13(10-12-14)16(2,3)4/h11,13H,5-10,12H2,1-4H3
• InChIKey: BGZIFAVSQPGNJR-UHFFFAOYSA-N

Properties

• Density: 0.931g/cm³ (Cal.)
• Boiling point: 335.654°C at 760 mmHg (Cal.)
• Flash point: 139.119°C (Cal.)