(1S,2S,6R)-6-Formyl-2-Methyl-3-Cyclohexene-1-Carboxylic Acid
[CAS# 16041-33-1]

Identification

• Name: (1S,2S,6R)-6-Formyl-2-Methyl-3-Cyclohexene-1-Carboxylic Acid
• Synonyms: (1S,2S,6R)-6-formyl-2-methylcyclohex-3-enecarboxylic acid
• Molecular Formula: C₉H₁₂O₃
• Molecular Weight: 168.19
• CAS Registry Number: 16041-33-1
• SMILES: C[C@H]1C=CC[C@H]([C@H]1C(=O)O)C=O
• InChI: 1S/C9H12O3/c1-6-3-2-4-7(5-10)8(6)9(11)12/h2-3,5-8H,4H2,1H3,(H,11,12)/t6-,7-,8-/m0/s1
• InChIKey: AMPNPSSFZDICQI-FXQIFTODSA-N

Properties

• Density: 1.214g/cm³ (Cal.)
• Boiling point: 307.666°C at 760 mmHg (Cal.)
• Flash point: 154.095°C (Cal.)
• Refractive index: 1.558 (Cal.)