화학공학소재연구정보센터
Journal of Physical Chemistry A, Vol.120, No.44, 8823-8829, 2016
Rate Coefficients for the Reactions of OH Radicals with a Series of Alkyl-Substituted Amines
Rate coefficients have been determined at (298 +/- 2) K and atmospheric pressure for the reaction of OH radicals with two primary monoalkyl-, one secondary dialkyl-, and five tertiary trialkyl-substituted amines in a large volume photoreactor by the relative kinetic technique. The following rate coefficients (in cm(3) molecule(-1) s(-1) units) have been obtained: (1) 1,2-dimethylpropylamine, CH3C(CH3)-HC(CH3)H)NH2, (5.08 +/- 1.02) x 10(-11); (2) tert-amylamine (tert-pentylamine), CH3CH2C(CH3)(2)NH2, (0.86 +/- 0.17) X 10(-11); (3) diethylamine, (CH3CH2)(2)NH, (7.36 +/- 1.47) X 10(-11); (4) N,N-dimethylethylamine, (CH3)(2)NCH2CH3, (7.37 +/- 1.47) X 10(-11); (5) N,N-dimethylpropylamine, (CH3)(2)NCH2CH2CH3, (10.97 +/- 1.78) x 10(-11); (6) N,N-dimethylisopropylamine, (CH3)(2)NCH(CH3)(2), (9.79 +/- 1.75) X 10(-11); (7) N,N-diethylmethylamine, (CH3CH2)(2)NCH3, (8.92 +/- 1.54) X 10(-11); (8) triethylamine, (CH3CH2)(3)N, (10.86 +/- 1.88) X 10(-11). The quoted errors are the 2 sigma deviations from least-squares linear analysis of the kinetic data plus a contribution to take into account uncertainties associated with the reference compounds. With the exception of diethylamine, this study represents the first determinations of the rate coefficients for reaction of the compounds with OH radicals. The results are compared with rate coefficients available in the literature for smaller alkyl-substituted amines and also the values predicted for the compounds investigated by using a structure activity relationship (SAR). With the exception of tent-amylamine, the SAR-predicted OH rate coefficients are in good agreement with the experimental values.