[(E,3S)-1-(2,6,6-Trimethyl-1-Cyclohexenyl)Pent-1-En-3-Yl] Acetate
[CAS# 137085-37-1]

Identification

• Name: [(E,3S)-1-(2,6,6-Trimethyl-1-Cyclohexenyl)Pent-1-En-3-Yl] Acetate
• Synonyms: [(E,1S)-1-Ethyl-3-(2,6,6-Trimethyl-1-Cyclohexenyl)Prop-2-Enyl] Acetate; Acetic Acid [(E,1S)-1-Ethyl-3-(2,6,6-Trimethyl-1-Cyclohexenyl)Prop-2-Enyl] Ester; [(E,3S)-1-(2,6,6-Trimethyl-1-Cyclohexenyl)Pent-1-En-3-Yl] Ethanoate
• Molecular Formula: C₁₆H₂₆O₂
• Molecular Weight: 250.38
• CAS Registry Number: 137085-37-1
• SMILES: [C@H](CC)(\C=C\C1=C(CCCC1(C)C)C)OC(=O)C
• InChI: 1S/C16H26O2/c1-6-14(18-13(3)17)9-10-15-12(2)8-7-11-16(15,4)5/h9-10,14H,6-8,11H2,1-5H3/b10-9+/t14-/m0/s1
• InChIKey: ZFLGHRQDYOPHNY-HBWSCVEGSA-N

Properties

• Density: 0.963g/cm³ (Cal.)
• Boiling point: 323.897°C at 760 mmHg (Cal.)
• Flash point: 102.941°C (Cal.)