rel-(4Z)-6-[(2R,4R,5S)-2-(2-Chlorophenyl)-4-(2-hydroxyphenyl)-1,3-dioxan-5-yl]-4-hexenoic acid
[CAS# 117621-64-4]

Identification

• Name: rel-(4Z)-6-[(2R,4R,5S)-2-(2-Chlorophenyl)-4-(2-hydroxyphenyl)-1,3-dioxan-5-yl]-4-hexenoic acid
• Synonyms: ICI 191606; ICI 192605
• Molecular Formula: C₂₂H₂₃ClO₅
• Molecular Weight: 402.87
• CAS Registry Number: 117621-64-4
• EC Number: 689-667-2

Properties

• Solubility: Insoluble (8.9E^-3 g/L) (25 ºC), Calc.^*
• Density: 1.262±0.06 g/cm³ (20 ºC 760 Torr), Calc.^*
• Melting point: 124-126 ºC^**

^* Calculated using Advanced Chemistry Development (ACD/Labs) Software V11.02 (©1994-2017 ACD/Labs)

^** Brewster, A. G.; Prostaglandins 1988, V36(2), P173-8.

Safety Data

Hazard Classification

Hazard	Class	Category Code	Hazard Statement
Acute hazardous to the aquatic environment	Aquatic Acute	1	H400
Chronic hazardous to the aquatic environment	Aquatic Chronic	1	H410
Acute toxicity	Acute Tox.	4	H302