Y. Maham et al., MOLAR HEAT-CAPACITIES OF ALKANOLAMINES FROM 299.1 TO 397.8 K - GROUP ADDITIVITY AND MOLECULAR CONNECTIVITY ANALYSES, Journal of the Chemical Society. Faraday transactions, 93(9), 1997, pp. 1747-1750
Citations number
18
Categorie Soggetti
Chemistry Physical","Physics, Atomic, Molecular & Chemical
The molar heat capacities of 14 alkanolamine compounds have been measu
red at five separate temperatures in the range 299.1 to 397.8 K. These
compounds were monoethanolamine (MEA), monomethylethanolamine (MMEA),
dimethylethanolamine (DMEA), monoethylethanolamine (MEEA), diethyleth
anolamine (DEEA), n-propylethanolamine (n-PEA), diisopropylethanolamin
e (di-PEA), diethanolamine (DEA), methyldiethanolamine (MDEA), ethyldi
ethanolamine (EDEA), n-butyldiethanolamine (n-BDEA), tert-butyldiethan
olamine (tert-BDEA), triethanolamine (TEA) and 2-amino-2-methylpropan-
1-ol (AMP). Molar heat capacities of these compounds show a structural
dependence, where the molar heat capacity of one molecule may be cons
idered as the sum of various group contributions. Hence, the reported
molar heat capacity data have been used as input to a group additivity
analysis that yields estimates of CH2, OH, NH and N group contributio
ns to molar heat capacities at each investigated temperature. The addi
tivity principle has been explored in more detail by using molecular c
onnectivity indexes to obtain a simple five-term equation that models
the molar heat capacities of the investigated alkanolamines over the e
ntire experimental temperature range.