Liu, S.; Cai, S.; Cao, C.; Li, Z. Molecular Electronegative Distance Vector (MEDV) Related to 15 Properties of Alkanes. J. Chem. Inf. Model. 2000, 40, 6, 1337–1348.

150 compounds

ID	Name	Details
1	methane	View
2	ethane	View
3	propane	View
4	butane	View
5	2-methylpropane	View
6	pentane	View
7	2-methylbutane	View
8	2,2-dimethylpropane	View
9	hexane	View
10	2-methylpentane	View
11	3-methylpentane	View
12	2,2-dimethylbutane	View
13	2,3-dimethylbutane	View
14	heptane	View
15	2-methylhexane	View
16	3-methylhexane	View
17	2,2-dimethylpentane	View
18	2,3-dimethylpentane	View
19	2,4-dimethylpentane	View
20	3,3-dimethylpentane	View
21	3-ethylpentane	View
22	2,2,3-trimethylbutane	View
23	octane	View
24	2-methylheptane	View
25	3-methylheptane	View
26	4-methylheptane	View
27	2,2-dimethylhexane	View
28	2,3-dimethylhexane	View
29	2,4-dimethylhexane	View
30	2,5-dimethylhexane	View
31	3,3-dimethylhexane	View
32	3,4-dimethylhexane	View
33	3-ethylhexane	View
34	2,2,3-trimethylpentane	View
35	2,2,4-trimethylpentane	View
36	2,3,3-trimethylpentane	View
37	2,3,4-trimethylpentane	View
38	2-methyl-3-ethylpentane	View
39	3-methyl-3-ethylpentane	View
40	2,2,3,3-tetramethylbutane	View
41	nonane	View
42	2-methyloctane	View
43	3-methyloctane	View
44	4-methyloctane	View
45	2,2-dimethylheptane	View
46	2,3-dimethylheptane	View
47	2,4-dimethylheptane	View
48	2,5-dimethylheptane	View
49	2,6-dimethylheptane	View
50	3,3-dimethylheptane	View
51	3,4-dimethylheptane	View
52	3,5-dimethylheptane	View
53	4,4-dimethylheptane	View
54	3-ethylheptane	View
55	4-ethylheptane	View
56	2,2,3-trimethylhexane	View
57	2,2,4-trimethylhexane	View
58	2,2,5-trimethylhexane	View
59	2,3,3-trimethylhexane	View
60	2,3,4-trimethylhexane	View
61	2,3,5-trimethylhexane	View
62	2,4,4-trimethylhexane	View
63	3,3,4-trimethylhexane	View
64	2-methyl-3-ethylhexane	View
65	2-methyl-4-ethylhexane	View
66	3-methyl-3-ethylhexane	View
67	3-methyl-4-ethylhexane	View
68	2,2,3,3-tetramethylpentane	View
69	2,2,3,4-tetramethylpentane	View
70	2,2,4,4-tetramethylpentane	View
71	2,3,3,4-tetramethylpentane	View
72	2,2-dimethyl-3-ethylpentane	View
73	2,3-dimethyl-3-ethylpentane	View
74	2,4-dimethyl-3-ethylpentane	View
75	3,3-diethylpentane	View
76	decane	View
77	2-methylnonane	View
78	3-methylnonane	View
79	4-methylnonane	View
80	5-methylnonane	View
81	2,2-dimethyloctane	View
82	2,3-dimethyloctane	View
83	2,4-dimethyloctane	View
84	2,5-dimethyloctane	View
85	2,6-dimethyloctane	View
86	2,7-dimethyloctane	View
87	3,3-dimethyloctane	View
88	3,4-dimethyloctane	View
89	3,5-dimethyloctane	View
90	3,6-dimethyloctane	View
91	4,4-dimethyloctane	View
92	4,5-dimethyloctane	View
93	3-ethyloctane	View
94	4-ethyloctane	View
95	2,2,3-trimethylheptane	View
96	2,2,4-trimethylheptane	View
97	2,2,5-trimethylheptane	View
98	2,2,6-trimethylheptane	View
99	2,3,3-trimethylheptane	View
100	2,3,4-trimethylheptane	View
101	2,3,5-trimethylheptane	View
102	2,3,6-trimethylheptane	View
103	2,4,4-trimethylheptane	View
104	2,4,5-trimethylheptane	View
105	2,4,6-trimethylheptane	View
106	2,5,5-trimethylheptane	View
107	3,3,4-trimethylheptane	View
108	3,3,5-trimethylheptane	View
109	3,4,4-trimethylheptane	View
110	3,4,5-trimethylheptane	View
111	2-methyl-3-ethylheptane	View
112	2-methyl-4-ethylheptane	View
113	2-methyl-5-ethylheptane	View
114	3-methyl-3-ethylheptane	View
115	3-methyl-4-ethylheptane	View
116	3-methyl-5-ethylheptane	View
117	4-methyl-3-ethylheptane	View
118	4-methyl-4-ethylheptane	View
119	4-propylheptane	View
120	4-isopropylheptane	View
121	2,2,3,3-tetramethylhexane	View
122	2,2,3,4-tetramethylhexane	View
123	2,2,3,5-tetramethylhexane	View
124	2,2,4,4-tetramethylhexane	View
125	2,2,4,5-tetramethylhexane	View
126	2,2,5,5-tetramethylhexane	View
127	2,3,3,4-tetramethylhexane	View
128	2,3,3,5-tetramethylhexane	View
129	2,3,4,4-tetramethylhexane	View
130	2,3,4,5-tetramethylhexane	View
131	3,3,4,4-tetramethylhexane	View
132	2,2-dimethyl-3-ethylhexane	View
133	2,2-dimethyl-4-ethylhexane	View
134	2,3-dimethyl-3-ethylhexane	View
135	2,3-dimethyl-4-ethylhexane	View
136	2,4-dimethyl-3-ethylhexane	View
137	2,4-dimethyl-4-ethylhexane	View
138	2,5-dimethyl-3-ethylhexane	View
139	3,3-dimethyl-4-ethylhexane	View
140	3,4-dimethyl-3-ethylhexane	View
141	3,3-diethylhexane	View
142	3,4-diethylhexane	View
143	2-methyl-3-isopropylhexane	View
144	2,2,3,3,4-pentamethylpentane	View
145	2,2,3,4,4-pentamethylpentane	View
146	2,2,3-trimethyl-3-ethylpentane	View
147	2,2,4-trimethyl-3-ethylpentane	View
148	2,3,4-trimethyl-3-ethylpentane	View
149	2-methyl-3,3-diethylpentane	View
150	2,4-dimethyl-3-isopropylpentane	View

10967/122 - QDB Compounds

QsarDB Repository

Liu, S.; Cai, S.; Cao, C.; Li, Z. Molecular Electronegative Distance Vector (MEDV) Related to 15 Properties of Alkanes. J. Chem. Inf. Model. 2000, 40, 6, 1337–1348.

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