3444-72-2

Basic information

• Product Name: ETHYL 2-HYDROXYCYCLOHEXANECARBOXYLATE
• Synonyms: ETHYL 2-HYDROXYCYCLOHEXANECARBOXYLATE
• CAS NO: 3444-72-2
• Molecular Formula: C₉H₁₆O₃
• Molecular Weight: 172.22
• Product Categories: pharmacetical
• Mol File: 3444-72-2.mol
• Article Data: 24

Chemical Properties

• Boiling Point: 251.4 °C at 760 mmHg
• Flash Point: 100.2 °C
• Appearance: /
• Density: 1.093 g/cm³
• Vapor Pressure: 0.00322mmHg at 25°C
• Refractive Index: 1.481
• Storage Temp.: Sealed in dry,Room Temperature
• PKA: 14.67±0.40(Predicted)
• CAS DataBase Reference: ETHYL 2-HYDROXYCYCLOHEXANECARBOXYLATE(CAS DataBase Reference)
• NIST Chemistry Reference: ETHYL 2-HYDROXYCYCLOHEXANECARBOXYLATE(3444-72-2)
• EPA Substance Registry System: ETHYL 2-HYDROXYCYCLOHEXANECARBOXYLATE(3444-72-2)

Safety Data

• Hazardous Substances Data: 3444-72-2(Hazardous Substances Data)

Usage

Synthesis Reference(s)

Synthesis, p. 897, 1990 DOI: 10.1055/s-1990-27047

InChI:InChI=1/C9H16O3/c1-2-12-9(11)7-5-3-4-6-8(7)10/h7-8,10H,2-6H2,1H3

Upstream product

• 1655-07-8 ethyl 2-oxocyclohexane carboxylate 
• 64-17-5 ethanol 
• 7664-93-9 sulfuric acid 
• 7732-18-5 water 
• 118-61-6 2-hydroxy-benzoic acid ethyl ester 
• 286-20-4 cyclohexene oxide 
• 201230-82-2 carbon monoxide 
• 132279-08-4 ethyl 2,3-tetramethyleneglycidate 
• 6149-48-0 ethyl 7-hydroxyheptanoate 
• 294212-84-3 2-bromo-7-triethylsilanyloxy-heptanoic acid ethyl ester 
• 294212-83-2 ethyl 7-triethylsilyloxyheptanoate 
• 294212-85-4 ethyl 2-bromo-7-hydroxyheptanoate 
• 294212-89-8 ethyl 2-bromo-7-oxoheptanoate 
• 609-69-8 trans-2-hydroxycyclohexanecarboxylic acid 

Downstream Products

• 1655-07-8 ethyl 2-oxocyclohexane carboxylate 
• 122629-66-7 2-benzyloxymethyl-2-ethoxycarbonylcyclohexanol; 
• 21651-72-9 (+/-)-cis-2-hydroxy-cyclohexane-carboxylic acid-⁽¹⁾-hydrazide 
• 119068-36-9 ethyl anti-(1R,2R)-2-hydroxycyclohexanecarboxylate 
• 29569-79-7 ethyl (1S,2S)-2-hydroxycyclohexanecarboxylate 
• 61586-78-5 ethyl (1R,2S)-2-hydroxycyclohexane-1-carboxylate 
• 187263-73-6 ethyl (1S,2R)-2-acetoxycyclohexanecarboxylate 
• 77612-23-8 N-methyl-trans-2-hydroxycyclohexane-1-carboxamide 
• 77612-23-8 N-methyl-cis-2-hydroxy-1-cyclohexanecarboxamide 

Relevant articles and documents

Investigation of Electrostatic Interactions towards Controlling Silylation-Based Kinetic Resolutions

Electrostatic interactions between a silylated isothiourea intermediate and an ester π system were explored by determining how variations in sterics and electronics affect the selectivity of a silylation-based kinetic resolution. Sterics on the π systems affect the selectivity factors of alkyl 2-hydroxycyclohexanecarboxylates, resulting in a strong correlation of selectivity factors to Charton values. Induction effects of electron-withdrawing substituents on phenyl esters significantly enhance selectivity supporting an edge to face π–π interaction. The linear free energy relationships that were uncovered will aid in future incorporation of intermolecular electrostatic interactions towards controlling asymmetric reactions.

BIARYL PYRAZOLES AS NRF2 REGULATORS

The present invention relates to biaryl pyrazole compounds, methods of making them, pharmaceutical compositions containing them and their use as NRF2 regulators.

Synthesis and characterization of the enantiomerically pure cis- and trans-2,4-dioxa-3-fluoro-3-phosphadecalins as inhibitors of acetylcholinesterase

The title compounds, the P(3)-axially- and P(3)-equatorially-substituted cis- and trans-configured 3-fluoro-2,4-dioxa-3-phosphadecalin 3-oxides (= 3-fluoro-2,4-dioxa-3-phosphabicyclo[4.4.0]decane 3-oxides) have been prepared (ee > 99%) and fully character