114967-85-0

Basic information

• Product Name: {[(8xi,9xi,14xi)-17-hydroxy-3,20-dioxopregn-4-en-21-yl]sulfanyl}acetic acid
• CAS NO: 114967-85-0
• Molecular Formula: C₂₃H₃₂O₅S
• Molecular Weight: 420.5622
• Mol File: 114967-85-0.mol
• Article Data: 1

Chemical Properties

• Boiling Point: 607.2°C at 760 mmHg
• Flash Point: 321°C
• Density: 1.28g/cm³
• Vapor Pressure: 2.8E-17mmHg at 25°C
• Refractive Index: 1.598
• CAS DataBase Reference: {[(8xi,9xi,14xi)-17-hydroxy-3,20-dioxopregn-4-en-21-yl]sulfanyl}acetic acid(CAS DataBase Reference)
• NIST Chemistry Reference: {[(8xi,9xi,14xi)-17-hydroxy-3,20-dioxopregn-4-en-21-yl]sulfanyl}acetic acid(114967-85-0)
• EPA Substance Registry System: {[(8xi,9xi,14xi)-17-hydroxy-3,20-dioxopregn-4-en-21-yl]sulfanyl}acetic acid(114967-85-0)

Safety Data

• Hazardous Substances Data: 114967-85-0(Hazardous Substances Data)

Upstream product

• 4470-79-5 21-Iodo-17α-hydroxypregn-4-en-3,20-dione 
• 68-11-1 mercaptoacetic acid 

Relevant articles and documents

REDUCTIVE DEHALOGENATION OF 21-IODO DERIVATIVES OF CORTICOSTEROIDS

In the reactions of 21-iodo derivatives of corticosteroids with hydrogen sulfide and thiol-containing reagents in a medium of dipolar aprotic and amide protogenic solvents at room temperature reductive-deiodination reactions occur with the formation of 21-deoxycorticosteroids in quantitative yield.Reactions of solutions of 21-iodomethyl ketones, heated to 80 deg C, with hydrogen sulfide and thiol-containing reagents give not only reduction products, but also products of nucleophilic substitution at C21 in yields of 20-30percent.