Monomers
Fumaric acid bis[3-[tris(trimethylsiloxy)silyl]propyl] ester
Identifiers
IUPAC name
bis[3-tris(trimethylsilyloxy)silylpropyl] (E)-but-2-enedioate
InchI
InChI=1S/C28H68O10Si8/c1-39(2,3)33-45(34-40(4,5)6,35-41(7,8)9)25-19-23-31-27(29)21-22-28(30)32-24-20-26-46(36-42(10,11)12,37-43(13,14)15)38-44(16,17)18/h21-22H,19-20,23-26H2,1-18H3/b22-21+
InchI Key
PBTFWLWNVIYIIR-QURGRASLSA-N
SMILES
O=C(/C=C/C(=O)OCCC[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C)OCCC[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C
Canonical SMILES
C[Si](C)(C)O[Si](CCCOC(=O)C=CC(=O)OCCC[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C
Isomeric SMILES
C[Si](C)(C)O[Si](CCCOC(=O)/C=C/C(=O)OCCC[Si](O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C)(O[Si](C)(C)C)O[Si](C)(C)C
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C28H68O10Si8
Heavy Atom Count
46
Molecular Weight
789.53
Exact Molecular Weight
788.2967
Valence Electrons
272
Radical Electrons
0
tPSA
107.98
MolLogP
8.396
H Bond Acceptors
10
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0
MOL File
RDKit 3D
114113 0 0 0 0 0 0 0 0999 V2000
-0.9957 -1.1998 0.6784 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.3437 -0.0222 0.5894 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5487 1.0038 -0.0167 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6064 0.9090 -0.5546 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4452 -0.2466 -0.7097 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1632 -1.3818 -0.3247 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7047 -0.1370 -1.3465 O 0 0 0 0 0 0 0 0 0 0 0 0
3.5683 -1.2149 -1.5299 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9584 -1.7843 -0.1910 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6263 -0.7553 0.6630 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1612 -0.1127 -0.1792 Si 0 0 0 0 0 4 0 0 0 0 0 0
6.6970 -1.4277 -1.1833 O 0 0 0 0 0 0 0 0 0 0 0 0
7.9738 -2.3050 -0.5302 Si 0 0 0 0 0 4 0 0 0 0 0 0
7.6365 -4.1240 -0.9240 C 0 0 0 0 0 0 0 0 0 0 0 0
9.6144 -1.9046 -1.3243 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1638 -2.1617 1.3047 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6512 1.0987 -1.2620 O 0 0 0 0 0 0 0 0 0 0 0 0
6.8123 2.1943 -1.7607 Si 0 0 0 0 0 4 0 0 0 0 0 0
6.9070 3.7319 -0.7314 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3427 2.7483 -3.5069 C 0 0 0 0 0 0 0 0 0 0 0 0
8.4774 1.3665 -1.8679 C 0 0 0 0 0 0 0 0 0 0 0 0
7.4028 0.2895 0.8419 O 0 0 0 0 0 0 0 0 0 0 0 0
7.1060 1.2439 2.1804 Si 0 0 0 0 0 4 0 0 0 0 0 0
5.3455 1.7853 2.4140 C 0 0 0 0 0 0 0 0 0 0 0 0
7.5362 0.2159 3.7074 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1871 2.7645 2.2595 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6016 0.3349 1.1164 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.4001 -0.6454 1.7097 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7939 -1.7744 0.8191 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5393 -1.4120 -0.4202 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.1724 -0.5718 -0.1484 Si 0 0 0 0 0 4 0 0 0 0 0 0
-6.0554 0.4873 1.1668 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.0919 2.1309 0.7634 Si 0 0 0 0 0 4 0 0 0 0 0 0
-7.8661 2.7588 0.8618 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.1255 3.0703 2.0841 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.3460 2.5181 -0.8872 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.5649 0.2581 -1.6038 O 0 0 0 0 0 0 0 0 0 0 0 0
-7.6838 -0.5720 -2.5748 Si 0 0 0 0 0 4 0 0 0 0 0 0
-9.3885 0.1899 -2.3355 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.7507 -2.3924 -2.2916 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.2327 -0.3084 -4.3914 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.3542 -1.7716 0.0792 O 0 0 0 0 0 0 0 0 0 0 0 0
-8.2971 -1.5907 1.4710 Si 0 0 0 0 0 4 0 0 0 0 0 0
-8.9758 -3.3066 1.8848 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.2790 -1.0307 2.9169 C 0 0 0 0 0 0 0 0 0 0 0 0
-9.7842 -0.4932 1.2281 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0024 2.0454 -0.0227 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0261 1.8861 -0.9690 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5124 -0.7957 -1.9842 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1458 -2.0060 -2.1910 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1740 -2.3285 0.3302 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7400 -2.5719 -0.4338 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8320 -1.1065 1.6939 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9330 0.1034 0.7665 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5998 -4.6357 -0.8704 H 0 0 0 0 0 0 0 0 0 0 0 0
7.2324 -4.1254 -1.9747 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8836 -4.5162 -0.2119 H 0 0 0 0 0 0 0 0 0 0 0 0
10.2617 -2.8168 -1.2053 H 0 0 0 0 0 0 0 0 0 0 0 0
9.5501 -1.6888 -2.3887 H 0 0 0 0 0 0 0 0 0 0 0 0
10.1022 -1.1232 -0.7128 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9370 -1.4247 1.6017 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5745 -3.1469 1.6779 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1960 -2.0388 1.8272 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3119 3.7239 0.1768 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5984 4.6605 -1.2904 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9828 3.9167 -0.4631 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8469 2.1341 -4.2638 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2396 2.6000 -3.6724 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5259 3.8333 -3.6438 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2323 2.1693 -2.1031 H 0 0 0 0 0 0 0 0 0 0 0 0
8.7808 0.8618 -0.9301 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5237 0.6288 -2.7149 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7359 0.9852 2.8478 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3699 2.6778 3.1073 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9461 2.2013 1.4638 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5703 -0.1266 3.6933 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3482 0.8173 4.6264 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8830 -0.6812 3.7758 H 0 0 0 0 0 0 0 0 0 0 0 0
8.7936 2.7865 3.1840 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9329 2.7560 1.4173 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5851 3.6967 2.2498 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2203 -0.1781 2.2807 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7209 -1.1204 2.5016 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9328 -2.4416 0.6326 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5092 -2.4083 1.4442 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8562 -0.7985 -1.0542 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.6629 -2.3714 -0.9996 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.3318 2.1889 1.6948 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.8334 3.8194 1.1768 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.3802 2.6362 -0.0999 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.6042 4.0494 2.2894 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1156 3.2813 1.6779 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.9833 2.4430 2.9797 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.6769 1.7319 -1.2623 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.7455 3.4729 -0.8708 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.1724 2.7126 -1.6299 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.9385 0.1882 -3.3190 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.3049 1.2516 -2.0546 H 0 0 0 0 0 0 0 0 0 0 0 0
-10.0110 -0.4154 -1.6521 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.9507 -2.9576 -3.2548 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.6117 -2.6726 -1.6466 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.8180 -2.8383 -1.9144 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.6218 -1.1736 -4.9873 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.1358 -0.2363 -4.4482 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.6807 0.6371 -4.7175 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.1616 -3.8726 0.9388 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.9774 -3.2191 2.3672 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.2771 -3.7968 2.5639 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.2321 -1.3445 2.8475 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.3605 0.0573 3.0474 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.6674 -1.4806 3.8694 H 0 0 0 0 0 0 0 0 0 0 0 0
-10.1952 -0.2510 2.2177 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.5719 0.4173 0.6585 H 0 0 0 0 0 0 0 0 0 0 0 0
-10.5399 -1.1145 0.6790 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 0
2 3 1 0
3 4 2 3
4 5 1 0
5 6 2 0
5 7 1 0
7 8 1 0
8 9 1 0
9 10 1 0
10 11 1 0
11 12 1 0
12 13 1 0
13 14 1 0
13 15 1 0
13 16 1 0
11 17 1 0
17 18 1 0
18 19 1 0
18 20 1 0
18 21 1 0
11 22 1 0
22 23 1 0
23 24 1 0
23 25 1 0
23 26 1 0
2 27 1 0
27 28 1 0
28 29 1 0
29 30 1 0
30 31 1 0
31 32 1 0
32 33 1 0
33 34 1 0
33 35 1 0
33 36 1 0
31 37 1 0
37 38 1 0
38 39 1 0
38 40 1 0
38 41 1 0
31 42 1 0
42 43 1 0
43 44 1 0
43 45 1 0
43 46 1 0
3 47 1 0
4 48 1 0
8 49 1 0
8 50 1 0
9 51 1 0
9 52 1 0
10 53 1 0
10 54 1 0
14 55 1 0
14 56 1 0
14 57 1 0
15 58 1 0
15 59 1 0
15 60 1 0
16 61 1 0
16 62 1 0
16 63 1 0
19 64 1 0
19 65 1 0
19 66 1 0
20 67 1 0
20 68 1 0
20 69 1 0
21 70 1 0
21 71 1 0
21 72 1 0
24 73 1 0
24 74 1 0
24 75 1 0
25 76 1 0
25 77 1 0
25 78 1 0
26 79 1 0
26 80 1 0
26 81 1 0
28 82 1 0
28 83 1 0
29 84 1 0
29 85 1 0
30 86 1 0
30 87 1 0
34 88 1 0
34 89 1 0
34 90 1 0
35 91 1 0
35 92 1 0
35 93 1 0
36 94 1 0
36 95 1 0
36 96 1 0
39 97 1 0
39 98 1 0
39 99 1 0
40100 1 0
40101 1 0
40102 1 0
41103 1 0
41104 1 0
41105 1 0
44106 1 0
44107 1 0
44108 1 0
45109 1 0
45110 1 0
45111 1 0
46112 1 0
46113 1 0
46114 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers