Page 340 - Characterization and Properties of Petroleum Fractions - M.R. Riazi
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            AT029-Manual
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                        AT029-Manual-v7.cls
                                           June 22, 2007
  AT029-07
         320 CHARACTERIZATION AND PROPERTIES OF PETROLEUM FRACTIONS
                 TABLE 7.7—Coefficients of Eq. (7.38) for liquid (A i , s) and solid (B i , s) heat capacity for some selected compounds [10].
                                               L
                                                                      2
                                                                            3
                                                     L
                                              C /R = C /R = A 1 + A 2 T + A 3 T + A 4 T + A 5 T 4
                                               P     V
                                                     S
                                                                      2
                                                                            3
                                               S
                                       (7.38)  C /R = C /R = B 1 + B 2 T + B 3 T + B 4 T + B 5 T 4
                                               P     V
         Compound.            M             A 1        A 2          A 3          A 4         A 5     T min ,K  T max ,K
         Liquid heat capacity, C L P
         n-Pentane           72.2           19.134  −3.254 × 10 −2  1.197 × 10 −4  0          0       143    390
         n-Hexane            86.2           20.702  −2.210 × 10 −2  1.067 × 10 −4  0          0       178    460
         n-Decane            142.3          33.512  −2.380 × 10 −2  1.291 × 10 −4  0          0       243    460
         n-Pentadecane       212.4          41.726  2.641 × 10 −2  7.894 × 10 −5  0           0       283    544
         n-Eicosane          282.5          42.425  9.710 × 10 −2  2.552 × 10 −5  0           0       309    617
         n-Hexatriacontane (C 36 )  507.0   84.311  1.771 × 10 −1    0           0            0       353    770
         Cyclohexane         84.2         −26.534   3.751 × 10 −1  −1.13 × 10 −3  1.285×10 −6  0      280    400
         Methylcyclohexane   98.2           15.797  −7.590 × 10 −3  9.773 × 10 −5  0          0       146    320
         Benzene             78.1           19.598  −4.149 × 10 −2  1.029 × 10 −4  0          0       279    500
         Toluene             92.1           16.856  −1.832 × 10 −2  8.359 × 10 −5  0          0       178    500
         Naphthalene         128.2          3.584   6.345 × 10 −2    0           0            0       353    491
         Anthracene          178.2          9.203   7.325 × 10 −2  −5.93 × 10 −6  0           0       489    655
         Carbon dioxide      44.0        −998.833   1.255 × 10  −5.21 × 10 −2  7.223 × 10 −5  0       220    290
         Water               18.0           33.242  −2.514 × 10 −1  9.77 × 10 −4  −1.698 × 10 −6  1.127 × 10 −9  273  533
                                 B 1        B 2        B 3          B 4          B 5                 T min ,K  T max ,K
         Solid heat capacity, C S P
         n-Pentane           −1.209        0.1215   5.136 × 10 −4  −1.22 × 10 −5  5.08 × 10 −8         12    134
         n-Hexane            −2.330        0.1992  −1.01 × 10 −3  2.43 × 10 −6   0                     20    178
         n-Decane            −4.198        0.3041  −1.52 × 10 −3  3.43 × 10 −6   0                     20    240
         n-Pentadecane       −311.823      1.3822       0            0           0                    271    283
         n-Eicosane          −0.650        0.3877  −1.57 × 10 −3  3.65 × 10 −6   0                     93    268
         n-Hexatriacontane (C 36 )  −200.000  1.0000    0            0           0                    300    325
         Cyclohexane          15.763      −0.0469   1.747 × 10 −4    0           0                    191    271
         Methylcyclohexane   −1.471        0.1597  −9.55 × 10 −4  3.06 × 10 −6   0                     12    146
         Benzene              0.890        0.0752  −3.23 × 10 −4  8.80 × 10 −7   0                     40    279
         Toluene             −0.433        0.1557  −1.05 × 10 −3  2.97 × 10 −6   0                     40    274
         Naphthalene          0.341        0.0949  −3.79 × 10 −4  1.34 × 10 −6  −1.34 × 10 −9          30    353
         Anthracene           2.436       0.0531    1.04 × 10 −4  −8.82 × 10 −8  3.69 × 10 −12         40    489
         Carbon dioxide      −2.199       0.1636   −1.46 × 10 −3  6.20 × 10 −6  −9.26 × 10 −9          25    216
         Water               −3.157 × 10 −2  0.0169     0            0           0                      3    273
               ig
         where C is the ideal gas molar heat capacity. Liquid heat ca-  For liquid petroleum fractions in the temperature range:
               P
         pacity increases with temperature. This equation can also be
         applied to nonhydrocarbons as well. This equation is recom-  145 ≤ T ≤ 0.8T c (T and T c both in kelvin)
         mended for T r ≤ 0.8 and an average error of about 2.5% was
                                L
         obtained for estimation of C of some 200 compounds at 25 C         a = 1.4651 + 0.2302 K W
                                                         ◦
                               P
         [12]. For 0.8 < T r < 0.99 values obtained from Eq. (7.40) may     b = 0.306469 − 0.16734 SG
         be corrected if heat capacity of saturated liquid is required:  (7.42)  c = 0.001467 − 0.000551 SG
                L
               C − C L                                        where K W is the Watson characterization factor defined in
        (7.41)  P    sat  = exp (2.1T r − 17.9) + exp (8.655 T r − 8.385)
                  R                                           Eq. (2.13). Preliminary calculations show that this equation
                                                                                  L
                                                              overpredicts values of C of pure hydrocarbons and accuracy
                                                                                  P
                L
         where C should be calculated from Eq. (7.40). When T r ≤  of this equation is about 5%. Equation (7.42) is recommended
                P
         0.8, it can be assumed that C = C L sat  and the correction term  in the ASTM D 2890 test method for calculation of heat ca-
                                L ∼
                                P
         may be neglected. C L sat  represents the energy required while  pacity of petroleum distillate fuels [25]. There are other forms
         maintaining the liquid in a saturated state. Most often C sat  similar to Eq. (7.42) correlating C of petroleum fractions to
                                                                                          L
                                                         L
                                                                                          P
         is measured experimentally while most predictive methods  SG, K W , and T using higher terms and orders for temperature
         estimate C [12].                                     but generally give similar results as that of Eq. (7.42). Simpler
                 L
                 P
                                                                                               L
          For petroleum fractions the pseudocomponent method  forms of relations for estimation of C of liquid petroleum
                                                                                              P
         similar to Eq. (7.35) can be used with M or T b of the fraction  fractions in terms of SG and T are also available in the lit-
                                                                                                 L
         as a characteristic parameter. However, there are some gen-  erature [26]. But their ability to predict C is very poor and
                                                                                                 P
         eralized correlations developed particularly for estimation of  in some cases lack information on the units or involve with
         heat capacity of liquid petroleum fractions. Kesler and Lee  some errors in the coefficients reported. The corresponding
                                               L
         [24] developed the following correlation for C of petroleum  states correlation of Eq. (7.40) may also be used for calcula-
                                               P
         fractions at low pressures:                          tion of heat capacity of liquid petroleum fractions using T c ,
                                                                     ig
                                                              ω, and C of the fraction. The API method [9] for calculation  --`,```,`,``````,`,````,```,,-`-`,,`,,`,`,,`---
                                                                     P
                                                                  L
                             L
                           C = a (b + cT)                     of C of liquid petroleum fractions is given in the following
                             P                                    P
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