(1R,4S,5R,7S)-4-Hydroxy-7-(hydroxymethyl)-5,7-dimethylbicyclo[3.2.1]oct-2-en-8-one
[CAS# 690662-20-5]

Identification

• Name: (1R,4S,5R,7S)-4-Hydroxy-7-(hydroxymethyl)-5,7-dimethylbicyclo[3.2.1]oct-2-en-8-one
• Molecular Formula: C₁₁H₁₆O₃
• Molecular Weight: 196.24
• CAS Registry Number: 690662-20-5
• SMILES: C[C@@]1(C[C@@]2([C@H](C=C[C@H]1C2=O)O)C)CO
• InChI: 1S/C11H16O3/c1-10(6-12)5-11(2)8(13)4-3-7(10)9(11)14/h3-4,7-8,12-13H,5-6H2,1-2H3/t7-,8-,10+,11+/m0/s1
• InChIKey: VFRGEIDUWDYVEP-OINDSLJFSA-N

Properties

• Density: 1.2±0.1g/cm³ (Cal.)
• Boiling point: 331.3±37.0°C at 760 mmHg (Cal.)
• Flash point: 168.4±23.0°C (Cal.)
• Refractive index: 1.554 (Cal.)