Computational study on hydroxybenzotriazoles as reagents for ester hydrolysis

Journal of Organic Chemistry

Volumn 69, Issue 25, 2004, Pages 8634-8642

  Kumar, Praveen ^a   Ganguly, Bishwajit ^b   Bhattacharya, Santanu ^a  

^a INDIAN INSTITUTE OF SCIENCE   (India)

^b CSIR CENTRAL SALT AND MARINE CHEMICALS RESEARCH INSTITUTE   (India)

Author keywords

[No Author keywords available]

Indexed keywords

CATALYSIS; DERIVATIVES; ESTERS; FREE ENERGY; HYDROLYSIS; MATHEMATICAL MODELS; MICELLES; PHENOLS; PROBABILITY DENSITY FUNCTION; PROTONS; SOLVENTS;

CATIONIC MICELLES; ESTEROLYTIC ACTIVITY; HYDROXYBENZOTRIAZOLES; SOLVATION-FREE ENERGIES;

BENZENE;

1 HYDROXYBENZOTRIAZOLE; 2 METHYLPROPIONALDEHYDE OXIME; 4 NITROPHENYL DIPHENYL PHOSPHATE; 4 NITROPHENYL HEXANOATE; BENZALDEHYDE DERIVATIVE; BENZALDEHYDE OXIME; BENZENE DERIVATIVE; BENZOTRIAZOLE DERIVATIVE; ESTER; HYDROXYBENZOTRIAZOLE; REAGENT; UNCLASSIFIED DRUG;

AB INITIO CALCULATION; ARTICLE; CALCULATION; CATALYST; CHEMICAL REACTION; DENSITY FUNCTIONAL THEORY; ENERGY; GEOMETRY; HYDROLYSIS; PH MEASUREMENT; PKA; POLARIZATION; PROTON TRANSPORT; SOLVATION;

EID: 84961980140     PISSN: 00223263     EISSN: None     Source Type: Journal    
DOI: 10.1021/jo049539w     Document Type: Article

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