Estimation of Carboxylic Acid Ester Hydrolysis Rate Constants

QSAR and Combinatorial Science

Volumn 22, Issue 9-10, 2004, Pages 917-925

  Hilal, S H ^a   Karickhoff, S W ^a   Carreira, L A ^b   Shrestha, B P ^b  

^a U S ENVIRONMENTAL PROTECTION AGENCY   (United States)

^b UNIVERSITY OF GEORGIA   (United States)

Author keywords

Carboxylic Acid Ester; Chemical Reactivity; Hydrolysis Rate Constant; SAR; SPARC

Indexed keywords

CHEMICAL BONDS; ESTERS; HYDROLYSIS; RATE CONSTANTS;

ACID ESTER; CARBOXYLIC ACID ESTER; ENERGY DIFFERENCES; ESTER HYDROLYSIS; HYDROLYSIS RATE CONSTANTS; INITIAL STATE; INTERNAL PERTURBATION; MECHANISTICS; REACTIVITY MODELS; SPARC;

CARBOXYLIC ACIDS;

ESTER; SOLVENT; WATER;

ANALYTIC METHOD; ANALYTICAL ERROR; ARTICLE; AUTOMATION; CALCULATION; CHEMICAL STRUCTURE; CHEMISTRY; ELECTRICITY; HYDROGEN BOND; HYDROLYSIS; PRIORITY JOURNAL; REACTION ANALYSIS; REACTION TIME; SOLUTE; STEREOCHEMISTRY; STRUCTURE ANALYSIS;

EID: 1042265257     PISSN: 1611020X     EISSN: None     Source Type: Journal    
DOI: 10.1002/qsar.200330836     Document Type: Article

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