(1S,2S)-3-[(S)-Isopropylsulfinyl]-3,5-Cyclohexadiene-1,2-Diol
[CAS# 499202-03-8]

Identification

• Name: (1S,2S)-3-[(S)-Isopropylsulfinyl]-3,5-Cyclohexadiene-1,2-Diol
• Synonyms: (1S,2S)-3-((S)-isopropylsulfinyl)cyclohexa-3,5-diene-1,2-diol
• Molecular Formula: C₉H₁₄O₃S
• Molecular Weight: 202.27
• CAS Registry Number: 499202-03-8
• SMILES: CC(C)[S@](=O)C1=CC=C[C@@H]([C@@H]1O)O
• InChI: 1S/C9H14O3S/c1-6(2)13(12)8-5-3-4-7(10)9(8)11/h3-7,9-11H,1-2H3/t7-,9-,13-/m0/s1
• InChIKey: RZRVXFHKCBEIDP-XICLSFFLSA-N

Properties

• Density: 1.3±0.1g/cm³ (Cal.)
• Boiling point: 434.2±45.0°C at 760 mmHg (Cal.)
• Flash point: 216.4±28.7°C (Cal.)
• Refractive index: 1.612 (Cal.)