926657-23-0

Basic information

• Product Name: (S)-1-(4-fluorophenyl)-3-iodopropan-1-ol
• Synonyms: (S)-1-(4-fluorophenyl)-3-iodopropan-1-ol;(alphaS)-4-Fluoro-alpha-(2-iodoethyl)benzenemethanol;(1S)-1-(4-fluorophenyl)-3-iodo-propan-1-ol;Benzenemethanol, 4-fluoro-α-(2-iodoethyl)-, (αS)-
• CAS NO: 926657-23-0
• Molecular Formula: C₉H₁₀FIO
• Molecular Weight: 280.0779732
• Mol File: 926657-23-0.mol
• Article Data: 3

Chemical Properties

• Melting Point: 70-71℃
• Boiling Point: 297.076°C at 760 mmHg
• Flash Point: 133.467°C
• Appearance: /
• Density: 1.749
• Vapor Pressure: 0.001mmHg at 25°C
• Refractive Index: 1.602
• Storage Temp.: 2-8°C
• PKA: 13.85±0.20(Predicted)
• CAS DataBase Reference: (S)-1-(4-fluorophenyl)-3-iodopropan-1-ol(CAS DataBase Reference)
• NIST Chemistry Reference: (S)-1-(4-fluorophenyl)-3-iodopropan-1-ol(926657-23-0)
• EPA Substance Registry System: (S)-1-(4-fluorophenyl)-3-iodopropan-1-ol(926657-23-0)

Safety Data

• Hazardous Substances Data: 926657-23-0(Hazardous Substances Data)

Usage

General Description

The chemical (S)-1-(4-fluorophenyl)-3-iodopropan-1-ol is an organic compound with a molecular formula C9H10FIO. It consists of a fluorophenyl group attached to a 3-iodopropan-1-ol moiety with a chiral center, giving it the configuration (S). (S)-1-(4-fluorophenyl)-3-iodopropan-1-ol is used in medicinal chemistry and pharmaceutical research as a potential building block for the synthesis of biologically active molecules. It has also shown potential as a ligand in metal catalyzed reactions. Its unique structure and reactivity make it a valuable tool in the development of new drugs and organic synthesis strategies.

InChI:InChI=1/C9H10FIO/c10-8-3-1-7(2-4-8)9(12)5-6-11/h1-4,9,12H,5-6H2/t9-/m0/s1

Upstream product

• 200004-40-6 (S)-3-chloro-1-(4-fluorophenyl)propan-1-ol 
• 851011-33-1 1-(4-fluoro-phenyl)-3-iodo-propan-1-one 

Downstream Products

• 923570-24-5 4S-(4-benzyloxy-phenyl)-3S-(4-fluoro-phenyl)-1-[3-(4-fluoro-phenyl)-3S-hydroxy-propyl]-azetidin-2-one 
• 923570-22-3 4R-(4-benzyloxy-phenyl)-3R-(4-fluoro-phenyl)-1-[3-(4-fluoro-phenyl)-3S-hydroxy-propyl]-azetidin-2-one 
• 1148041-56-8 (S)-tert-Butyl-[1-(4-fluorophenyl)-3-iodopropoxy]dimethylsilane 

Relevant articles and documents

Dynamic kinetic resolution: Asymmetrie transfer hydrogenation of α-alkyl-substituted β-ketoamides

[Chemical equation presented] Dynamic kinetic resolution (deracemization) of various a-alkyl-substituted β-ketoamides 1 via asymmetric transfer hydrogenation proceeded efficiently to give the corresponding syn-β-hydroxy amides 3 in high diastereo- and enantioselectivities. Specifically, subjection of 1 to HCO2H and Et3N in the presence of 0.5-1 mol % of pentafluorobenzenesulfonyl-DPEN-Ru catalyst 2b at 30-40 °C in either PhCH3 or CH2Cl2 generated the syn-hydroxy product 3 selectively in 15-33:1 dr, 93-97% ee, and 75-88% isolated yields.

Ezetimibe analogs with a reorganized azetidinone ring: Design, synthesis, and evaluation of cholesterol absorption inhibitions

The underlying principle of drug design in this paper is that the maximum retention of the functional groups that exist in the marketed drug would provide a higher probability for comparable safety while the conformational changes in the newly created ana