(2R,3R)-2-(3-Buten-1-yl)-3-isopropyl-2-methylcyclopentanone
[CAS# 844697-54-7]

Identification

• Name: (2R,3R)-2-(3-Buten-1-yl)-3-isopropyl-2-methylcyclopentanone
• Synonyms: (2R,3R)-2-(but-3-en-1-yl)-3-isopropyl-2-methylcyclopentanone
• Molecular Formula: C₁₃H₂₂O
• Molecular Weight: 194.31
• CAS Registry Number: 844697-54-7
• SMILES: O=C1CC[C@H](C(C)C)[C@]1(CC\C=C)C
• InChI: 1S/C13H22O/c1-5-6-9-13(4)11(10(2)3)7-8-12(13)14/h5,10-11H,1,6-9H2,2-4H3/t11-,13-/m1/s1
• InChIKey: DAKCCNNGKGFRLC-DGCLKSJQSA-N

Properties

• Density: 0.878g/cm³ (Cal.)
• Boiling point: 254.128°C at 760 mmHg (Cal.)
• Flash point: 97.844°C (Cal.)
• Refractive index: 1.454 (Cal.)