4-Tert-Butyl-1-Hydroxy-Cyclohexaneacetic Acid Tert-Butyl Ester
[CAS# 13278-12-1]

Identification

• Name: 4-Tert-Butyl-1-Hydroxy-Cyclohexaneacetic Acid Tert-Butyl Ester
• Synonyms: Tert-Butyl 2-(4-Tert-Butyl-1-Hydroxy-Cyclohexyl)Acetate; 2-(4-Tert-Butyl-1-Hydroxycyclohexyl)Acetic Acid Tert-Butyl Ester; 2-(4-Tert-Butyl-1-Hydroxy-Cyclohexyl)Acetic Acid Tert-Butyl Ester
• Molecular Formula: C₁₆H₃₀O₃
• Molecular Weight: 270.41
• CAS Registry Number: 13278-12-1
• SMILES: C(C1(CCC(CC1)C(C)(C)C)O)C(OC(C)(C)C)=O
• InChI: 1S/C16H30O3/c1-14(2,3)12-7-9-16(18,10-8-12)11-13(17)19-15(4,5)6/h12,18H,7-11H2,1-6H3
• InChIKey: QAOSMVQWHOXGSA-UHFFFAOYSA-N

Properties

• Density: 0.982g/cm³ (Cal.)
• Boiling point: 336.291°C at 760 mmHg (Cal.)
• Flash point: 124.442°C (Cal.)