Ethyl (1R,2R,3R,4S)-3-Isopropylbicyclo[2.2.1]Hept-5-Ene-2-Carboxylate
[CAS# 116126-82-0]

Identification

• Name: Ethyl (1R,2R,3R,4S)-3-Isopropylbicyclo[2.2.1]Hept-5-Ene-2-Carboxylate
• Synonyms: Bicyclo[2.2.1]hept-5-ene-2-carboxylic acid, 3-(1-methylethyl)-, ethyl ester, (2-exo,3-endo)-
• Molecular Formula: C₁₃H₂₀O₂
• Molecular Weight: 208.30
• CAS Registry Number: 116126-82-0
• SMILES: CCOC(=O)[C@@H]1[C@@H]2C[C@H]([C@H]1C(C)C)C=C2
• InChI: 1S/C13H20O2/c1-4-15-13(14)12-10-6-5-9(7-10)11(12)8(2)3/h5-6,8-12H,4,7H2,1-3H3/t9-,10+,11-,12-/m1/s1
• InChIKey: HJEFAEQTNTXLHL-WRWGMCAJSA-N

Properties

• Density: 1.017g/cm³ (Cal.)
• Boiling point: 260.658°C at 760 mmHg (Cal.)
• Flash point: 103.161°C (Cal.)
• Refractive index: 1.491 (Cal.)