(2S)-2-[(3Z)-3-Hexen-1-yl]-2-methylcycloheptanone
[CAS# 802903-35-1]

Identification

• Name: (2S)-2-[(3Z)-3-Hexen-1-yl]-2-methylcycloheptanone
• Synonyms: (S,Z)-2-(hex-3-en-1-yl)-2-methylcycloheptanone
• Molecular Formula: C₁₄H₂₄O
• Molecular Weight: 208.34
• CAS Registry Number: 802903-35-1
• SMILES: CC/C=C\CC[C@@]1(CCCCCC1=O)C
• InChI: 1S/C14H24O/c1-3-4-5-8-11-14(2)12-9-6-7-10-13(14)15/h4-5H,3,6-12H2,1-2H3/b5-4-/t14-/m1/s1
• InChIKey: PNCSIILJRNZFKL-ZRUQZJFASA-N

Properties

• Density: 0.9±0.1g/cm³ (Cal.)
• Boiling point: 290.0±9.0°C at 760 mmHg (Cal.)
• Flash point: 117.0±13.7°C (Cal.)
• Refractive index: 1.462 (Cal.)