6-(2-Hydroxy-2-propanyl)-3-methyl-2-cyclohexen-1-one
[CAS# 87791-00-2]

Identification

• Name: 6-(2-Hydroxy-2-propanyl)-3-methyl-2-cyclohexen-1-one
• Synonyms: 6-(1-Hydroxy-1-methylethyl)-3-methyl-2-cyclohexen-1-one #; 6-(2-hydroxypropan-2-yl)-3-methylcyclohex-2-enone
• Molecular Formula: C₁₀H₁₆O₂
• Molecular Weight: 168.23
• CAS Registry Number: 87791-00-2
• SMILES: O=C1\C=C(/CCC1C(O)(C)C)C
• InChI: 1S/C10H16O2/c1-7-4-5-8(9(11)6-7)10(2,3)12/h6,8,12H,4-5H2,1-3H3
• InChIKey: NESBMOKWNSKETJ-UHFFFAOYSA-N

Properties

• Density: 1.042g/cm³ (Cal.)
• Boiling point: 277.58°C at 760 mmHg (Cal.)
• Flash point: 116.114°C (Cal.)