2-[(1R,2R)-1-Hydroxy-2,4,6-Trimethyl-3-Oxo-1,2-Dihydroinden-5-Yl]Ethyl Acetate
[CAS# 39765-77-0]

Identification

• Name: 2-[(1R,2R)-1-Hydroxy-2,4,6-Trimethyl-3-Oxo-1,2-Dihydroinden-5-Yl]Ethyl Acetate
• Synonyms: 2-[(1R,2R)-1-Hydroxy-2,4,6-Trimethyl-3-Oxo-Indan-5-Yl]Ethyl Acetate; Acetic Acid 2-[(1R,2R)-1-Hydroxy-2,4,6-Trimethyl-3-Oxo-5-Indanyl]Ethyl Ester; Acetic Acid 2-[(1R,2R)-1-Hydroxy-3-Keto-2,4,6-Trimethyl-Indan-5-Yl]Ethyl Ester
• Molecular Formula: C₁₆H₂₀O₄
• Molecular Weight: 276.33
• CAS Registry Number: 39765-77-0
• SMILES: [C@@H]1(C(C2=C([C@@H]1O)C=C(C(=C2C)CCOC(=O)C)C)=O)C
• InChI: 1S/C16H20O4/c1-8-7-13-14(16(19)10(3)15(13)18)9(2)12(8)5-6-20-11(4)17/h7,10,15,18H,5-6H2,1-4H3/t10-,15-/m1/s1
• InChIKey: KBPAOKSMUDDOIN-MEBBXXQBSA-N

Properties

• Density: 1.182g/cm³ (Cal.)
• Boiling point: 447.827°C at 760 mmHg (Cal.)
• Flash point: 163.831°C (Cal.)