(1alpha,2alpha,5alpha)-4,5-Dimethyl-2-(2-Methylpropen-1-Yl)Cyclohex-3-Ene-1-Carbaldehyde
[CAS# 42507-58-4]

Identification

• Name: (1alpha,2alpha,5alpha)-4,5-Dimethyl-2-(2-Methylpropen-1-Yl)Cyclohex-3-Ene-1-Carbaldehyde
• Synonyms: (1R,2S,5S)-4,5-Dimethyl-2-(2-Methylprop-1-Enyl)-1-Cyclohex-3-Enecarboxaldehyde; (1Alpha,2Alpha,5Alpha)-4,5-Dimethyl-2-(2-Methylpropen-1-Yl)Cyclohex-3-Ene-1-Carbaldehyde
• Molecular Formula: C₁₃H₂₀O
• Molecular Weight: 192.30
• CAS Registry Number: 42507-58-4
• EINECS: 255-861-7
• SMILES: [C@H]1([C@@H](C[C@@H](C(=C1)C)C)C=O)C=C(C)C
• InChI: 1S/C13H20O/c1-9(2)5-12-6-10(3)11(4)7-13(12)8-14/h5-6,8,11-13H,7H2,1-4H3/t11-,12-,13-/m0/s1
• InChIKey: DBKJZSIBBKOBCN-AVGNSLFASA-N

Properties

• Density: 0.979g/cm³ (Cal.)
• Boiling point: 258.897°C at 760 mmHg (Cal.)
• Flash point: 90.147°C (Cal.)