(1R,2S)-3-(1,2-Thiazol-4-Ylmethyl)-3,5-Cyclohexadiene-1,2-Diol
[CAS# 503446-12-6]

Identification

• Name: (1R,2S)-3-(1,2-Thiazol-4-Ylmethyl)-3,5-Cyclohexadiene-1,2-Diol
• Synonyms: (1R,2S)-3-(isothiazol-4-ylmethyl)cyclohexa-3,5-diene-1,2-diol
• Molecular Formula: C₁₀H₁₁NO₂S
• Molecular Weight: 209.26
• CAS Registry Number: 503446-12-6
• SMILES: C1=C[C@H]([C@H](C(=C1)CC2=CSN=C2)O)O
• InChI: 1S/C10H11NO2S/c12-9-3-1-2-8(10(9)13)4-7-5-11-14-6-7/h1-3,5-6,9-10,12-13H,4H2/t9-,10+/m1/s1
• InChIKey: IRLFTBOUZLSJPR-ZJUUUORDSA-N

Properties

• Density: 1.4±0.1g/cm³ (Cal.)
• Boiling point: 320.7±42.0°C at 760 mmHg (Cal.)
• Flash point: 147.8±27.9°C (Cal.)
• Refractive index: 1.688 (Cal.)