S.N. | CAS NO | Descriptors | LogBCFexp | LogBCFpre | ||||||||||||
µ | IP | EA | χ | η | S | ω | Equation (8) | Equation (9) | Equation (10) | Equation (11) | Equation (12) | Equation (13) | Equation (14) | |||
1 | 92-52-4 | 0 | 5.557 | 1.982 | 3.770 | 1.788 | 0.280 | 3.975 | 2.64 | 2.77 | 2.74 | 2.42 | 2.47 | 2.48 | 2.55 | 2.37 |
2 | 2051-62-9 | 2.005 | 5.618 | 2.184 | 3.901 | 1.717 | 0.291 | 4.432 | 2.77 | 3.00 | 3.03 | 2.80 | 2.80 | 2.82 | 2.79 | 2.71 |
3 | 13029-08-8 | 3.141 | 5.809 | 2.427 | 4.118 | 1.691 | 0.296 | 5.014 | 3.38 | 3.72 | 3.77 | 3.77 | 3.74 | 3.74 | 3.65 | 3.69 |
4 | 16605-91-7 | 2.667 | 5.863 | 2.361 | 4.112 | 1.751 | 0.286 | 4.828 | 4.11 | 3.92 | 3.95 | 3.89 | 3.86 | 3.87 | 3.86 | 3.86 |
5 | 25569-80-6 | 3.442 | 5.893 | 2.395 | 4.144 | 1.749 | 0.286 | 4.909 | 3.80 | 4.04 | 4.09 | 4.03 | 3.99 | 4.00 | 4.04 | 4.08 |
6 | 33284-50-3 | 2.076 | 5.793 | 2.363 | 4.078 | 1.715 | 0.292 | 4.848 | 3.55 | 3.66 | 3.67 | 3.64 | 3.63 | 3.64 | 3.55 | 3.52 |
7 | 34883-43-7 | 2.713 | 5.774 | 2.367 | 4.071 | 1.704 | 0.294 | 4.863 | 3.57 | 3.59 | 3.62 | 3.65 | 3.62 | 3.62 | 3.53 | 3.57 |
8 | 34883-39-1 | 0.789 | 5.892 | 2.407 | 4.150 | 1.743 | 0.287 | 4.941 | 3.89 | 4.03 | 4.00 | 4.12 | 4.14 | 4.14 | 4.12 | 4.08 |
9 | 34883-41-5 | 2.414 | 5.951 | 2.428 | 4.190 | 1.762 | 0.284 | 4.982 | 3.78 | 4.26 | 4.27 | 4.35 | 4.33 | 4.34 | 4.37 | 4.41 |
10 | 2050-68-2 | 0 | 5.677 | 2.369 | 4.023 | 1.654 | 0.302 | 4.893 | 3.28 | 3.22 | 3.18 | 3.23 | 3.28 | 3.28 | 3.06 | 2.95 |
11 | 37680-65-2 | 1.770 | 6.048 | 1.907 | 3.978 | 2.071 | 0.241 | 3.820 | 4.11 | 4.62 | 4.60 | 4.08 | 4.08 | 4.07 | 4.15 | 4.10 |
12 | 7012-37-5 | 1.295 | 5.828 | 2.537 | 4.183 | 1.646 | 0.304 | 5.315 | 4.20 | 3.79 | 3.78 | 4.04 | 4.05 | 4.04 | 3.84 | 3.87 |
13 | 15862-07-4 | 2.200 | 5.92 | 2.535 | 4.228 | 1.693 | 0.295 | 5.279 | 4.26 | 4.14 | 4.15 | 4.37 | 4.35 | 4.35 | 4.34 | 4.40 |
14 | 16606-02-3 | 1.168 | 5.927 | 2.581 | 4.254 | 1.673 | 0.299 | 5.409 | 4.23 | 4.17 | 4.14 | 4.37 | 4.39 | 4.39 | 4.26 | 4.27 |
15 | 38444-93-8 | 3.668 | 6.233 | 1.998 | 4.116 | 2.118 | 0.236 | 3.999 | 4.23 | 5.33a | 5.35a | 4.84 | 4.79 | 4.77 | 4.69 | 4.76a |
16 | 41464-39-5 | 2.875 | 6.174 | 1.960 | 4.067 | 2.107 | 0.237 | 3.925 | 4.84 | 5.10 | 5.10 | 4.52 | 4.49 | 4.48 | 4.44 | 4.43 |
17 | 2437-79-8 | 2.024 | 6.138 | 2.203 | 4.171 | 1.968 | 0.254 | 4.420 | 4.85 | 4.97 | 4.94 | 4.75 | 4.74 | 4.74 | 4.80 | 4.79 |
18 | 70362-47-9 | 2.845 | 6.121 | 2.192 | 4.157 | 1.965 | 0.255 | 4.397 | 5.00 | 4.90 | 4.91 | 4.68 | 4.64 | 4.65 | 4.68 | 4.70 |
19 | 41464-40-8 | 1.376 | 6.12 | 2.189 | 4.155 | 1.966 | 0.254 | 4.391 | 4.84 | 4.90 | 4.86 | 4.67 | 4.68 | 4.68 | 4.76 | 4.72 |
20 | 35693-99-3 | 0.409 | 6.122 | 2.265 | 4.194 | 1.929 | 0.259 | 4.559 | 4.63 | 4.91 | 4.83 | 4.77 | 4.80 | 4.81 | 4.86 | 4.79 |
21 | 15968-05-5 | 0.011 | 6.194 | 1.812 | 4.003 | 2.191 | 0.228 | 3.657 | 3.85 | 5.18a | 5.08a | 4.41 | 4.46 | 4.42 | 4.19 | 4.08 |
22 | 52663-58-8 | 2.050 | 6.072 | 2.295 | 4.184 | 1.889 | 0.265 | 4.634 | 4.60 | 4.72 | 4.70 | 4.62 | 4.61 | 4.62 | 4.69 | 4.69 |
23 | 32598-11-1 | 2.204 | 6.039 | 2.727 | 4.383 | 1.656 | 0.302 | 5.800 | 4.77 | 4.59 | 4.58 | 4.95 | 4.93 | 4.93 | 4.86 | 4.97 |
24 | 32598-13-1 | 2.542 | 5.937 | 2.687 | 4.312 | 1.625 | 0.308 | 5.721 | 4.59 | 4.20 | 4.22 | 4.54 | 4.51 | 4.50 | 4.32 | 4.43 |
25 | 38380-02-8 | 2.311 | 6.164 | 2.363 | 4.264 | 1.901 | 0.263 | 4.782 | 5.38 | 5.06 | 5.05 | 5.03 | 5.01 | 5.02 | 5.10 | 5.13 |
26 | 68194-07-0 | 1.611 | 6.266 | 2.266 | 4.266 | 2.000 | 0.250 | 4.550 | 5.00 | 5.45 | 5.40 | 5.21 | 5.21 | 5.22 | 5.17 | 5.14 |
27 | 41464-51-1 | 2.648 | 6.216 | 2.334 | 4.275 | 1.941 | 0.258 | 4.708 | 5.43 | 5.26 | 5.25 | 5.11 | 5.09 | 5.10 | 5.10 | 5.12 |
28 | 38380-01-7 | 1.309 | 6.194 | 2.350 | 4.272 | 1.922 | 0.260 | 4.748 | 5.00 | 5.18 | 5.13 | 5.05 | 5.06 | 5.08 | 5.11 | 5.07 |
29 | 37680-73-2 | 1.437 | 5.971 | 2.084 | 4.028 | 1.944 | 0.257 | 4.173 | 5.40 | 4.33 | 4.31a | 4.01a | 4.02a | 4.03a | 4.16a | 4.10a |
30 | 32598-14-4 | 3.152 | 6.025 | 2.801 | 4.413 | 1.612 | 0.310 | 6.041 | 5.00 | 4.54a | 4.56 | 4.98 | 4.95 | 4.93 | 4.84 | 5.02 |
31 | 74472-35-8 | 1.993 | 6.222 | 2.395 | 4.309 | 1.914 | 0.261 | 4.850 | 5.00 | 5.28 | 5.25 | 5.28 | 5.27 | 5.28 | 5.35 | 5.38 |
32 | 31508-00-6 | 1.282 | 6.148 | 2.504 | 4.326 | 1.822 | 0.274 | 5.136 | 5.00 | 5.00 | 4.96 | 5.07 | 5.08 | 5.10 | 5.19 | 5.17 |
33 | 57465-28-8 | 1.412 | 6.062 | 2.826 | 4.444 | 1.618 | 0.309 | 6.103 | 5.81 | 4.68a | 4.64a | 5.15 | 5.15 | 5.13 | 5.02a | 5.14a |
34 | 38380-07-3 | 3.269 | 6.309 | 2.429 | 4.369 | 1.940 | 0.258 | 4.920 | 5.77 | 5.61 | 5.61 | 5.55 | 5.51 | 5.52 | 5.54 | 5.60 |
35 | 38411-22-2 | 1.453 | 6.222 | 2.130 | 4.176 | 2.046 | 0.244 | 4.262 | 5.43 | 5.28 | 5.23 | 4.89 | 4.90 | 4.90 | 4.86 | 4.80 |
36 | 35694-06-5 | 1.928 | 6.331 | 2.360 | 4.346 | 1.986 | 0.252 | 4.755 | 5.88 | 5.70 | 5.65 | 5.62 | 5.61 | 5.61 | 5.56 | 5.59 |
37 | 35065-28-2 | 1.997 | 6.325 | 2.260 | 4.293 | 2.033 | 0.246 | 4.533 | 5.39 | 5.67 | 5.63 | 5.48 | 5.47 | 5.46 | 5.38 | 5.40 |
38 | 52712-04-6 | 2.049 | 6.256 | 2.455 | 4.356 | 1.901 | 0.263 | 4.991 | 5.81 | 5.41 | 5.38 | 5.47 | 5.46 | 5.46 | 5.53 | 5.57 |