Mol. No. |
Molecular Formula |
LogP By |
Molar Refractivity |
Boiling Point
(K) |
Gibb’s Energy
(Kj/Mol) |
Crippen’s Fragmentation |
Vishwanathan’s Fragmentation |
Broto’s Fragmentation |
Crippen’s Method |
Vishwanathan’s Method |
1 |
C11H10N2S |
3.60 |
3.28 |
2.62 |
60.49 |
60.44 |
603.81 |
430.79 |
2 |
C11H10N2S |
3.60 |
3.28 |
2.62 |
60.49 |
60.44 |
603.81 |
430.79 |
3 |
C11H10N2S |
4.01 |
3.75 |
2.62 |
- |
- |
603.81 |
430.79 |
4 |
C12H12N2OS |
3.47 |
3.03 |
2.75 |
67.74 |
66.90 |
628.14 |
324.58 |
5 |
C11H10N2OS |
3.48 |
3.08 |
2.33 |
62.69 |
62.32 |
616.47 |
325.79 |
6 |
C12H12N2OS |
3.76 |
3.33 |
2.79 |
67.29 |
67.07 |
628.15 |
334.21 |
7 |
C17H14N2S |
5.25 |
4.85 |
3.89 |
84.73 |
85.10 |
683.70 |
597.45 |
8 |
C17H14N2OS |
4.86 |
4.57 |
3.50 |
86.54 |
86.80 |
718.54 |
442.83 |
9 |
C18H16N2OS |
5.12 |
4.60 |
4.02 |
91.97 |
91.57 |
707.36 |
491.24 |
10 |
C17H13N3O |
3.54 |
3.51 |
1.57 |
82.61 |
82.34 |
715.69 |
- |
11 |
C18H15N3O |
3.72 |
3.61 |
2.49 |
85.17 |
85.28 |
768.36 |
513.67 |
12 |
C17H13N3O2 |
3.81 |
3.70 |
1.85 |
82.56 |
83.07 |
719.19 |
320.41 |
13 |
C13H13N3 |
3.13 |
3.08 |
1.98 |
67.69 |
67.35 |
635.65 |
564.91 |
14 |
C16H13N3O2 |
3.23 |
3.41 |
1.48 |
80.46 |
80.29 |
751.09 |
313.12 |
15 |
C17H14N2O |
4.61 |
4.70 |
2.32 |
- |
- |
693.90 |
427.51 |
16 |
C11H11N3O |
2.43 |
2.53 |
0.08 |
- |
- |
652.32 |
331.03 |
17 |
C17H14N2O2 |
4.22 |
4.41 |
1.93 |
- |
- |
728.73 |
272.89 |
18 |
C17H13ClN2O |
5.17 |
5.21 |
2.94 |
- |
- |
712.59 |
405.95 |
19 |
C18H13ClN2O |
5.56 |
5.54 |
3.42 |
- |
- |
703.41 |
422.27 |
20 |
C5H7N3S |
1.41 |
1.11 |
0.37 |
40.57 |
40.69 |
552.64 |
334.31 |
|