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
1.1500 -0.2865 1.2641 O 0 0 0 0 0 0 0 0 0 0 0 0
1.0610 0.4944 0.2871 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2051 0.6085 -0.4101 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3000 1.4323 -1.4485 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5369 1.6000 -2.1962 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5921 2.3903 -3.1825 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.7038 0.9121 -1.8703 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.9007 1.1026 -2.6249 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.0161 0.2428 -2.0510 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.2717 0.6256 -0.5959 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.6477 -0.4256 0.0935 Si 0 0 0 0 0 4 0 0 0 0 0 0
-7.7951 0.5238 0.9588 O 0 0 0 0 0 0 0 0 0 0 0 0
-7.4137 2.1743 1.0081 Si 0 0 0 0 0 4 0 0 0 0 0 0
-7.5263 3.0048 -0.6641 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.7719 2.4254 1.8238 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.7225 2.9957 2.1046 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.9620 -1.5203 1.1942 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.9407 -3.1362 0.6933 Si 0 0 0 0 0 4 0 0 0 0 0 0
-7.5782 -4.0151 1.0189 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6706 -4.0201 1.7886 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.3999 -3.3854 -1.0561 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.5030 -1.2158 -1.1775 O 0 0 0 0 0 0 0 0 0 0 0 0
-9.2162 -1.0343 -0.9776 Si 0 0 0 0 0 4 0 0 0 0 0 0
-9.8228 0.5542 -1.7490 C 0 0 0 0 0 0 0 0 0 0 0 0
-10.0010 -2.4597 -1.8915 C 0 0 0 0 0 0 0 0 0 0 0 0
-9.7087 -1.1233 0.7996 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1493 1.2219 -0.1032 O 0 0 0 0 0 0 0 0 0 0 0 0
3.4040 1.1753 0.5118 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3086 2.1294 -0.2142 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6927 2.1663 0.3712 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4789 0.4753 0.2820 Si 0 0 0 0 0 4 0 0 0 0 0 0
8.1651 0.5047 0.3266 O 0 0 0 0 0 0 0 0 0 0 0 0
8.8877 1.9990 0.0014 Si 0 0 0 0 0 4 0 0 0 0 0 0
8.6062 3.2552 1.3352 C 0 0 0 0 0 0 0 0 0 0 0 0
8.4036 2.6287 -1.6839 C 0 0 0 0 0 0 0 0 0 0 0 0
10.7525 1.6766 -0.0705 C 0 0 0 0 0 0 0 0 0 0 0 0
5.8116 -0.5793 1.4609 O 0 0 0 0 0 0 0 0 0 0 0 0
6.7612 -0.7103 2.8544 Si 0 0 0 0 0 4 0 0 0 0 0 0
6.5046 0.7502 4.0077 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5643 -0.9490 2.5092 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1677 -2.2397 3.7902 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0106 -0.1717 -1.2616 O 0 0 0 0 0 0 0 0 0 0 0 0
6.8277 -1.6019 -1.6456 Si 0 0 0 0 0 4 0 0 0 0 0 0
6.7387 -2.9005 -0.3343 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6175 -1.1605 -2.0328 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0252 -2.2990 -3.1950 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0715 0.0408 -0.1049 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5676 2.0136 -1.7672 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6967 0.7551 -3.6571 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1474 2.1831 -2.5940 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.6403 -0.7990 -2.1010 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.9179 0.4057 -2.6528 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3011 0.4150 -0.0748 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.4364 1.6975 -0.4884 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.5078 2.2730 -1.5002 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.6817 3.7101 -0.7781 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.4473 3.6490 -0.7460 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.2074 1.4587 1.8832 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.9193 2.7345 2.8716 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.1752 3.2298 1.3385 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.2908 3.9241 2.5180 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.9674 2.3240 2.9563 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.6506 3.1705 1.5424 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.3923 -5.1056 1.1929 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.2261 -3.9725 0.1262 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.0440 -3.6467 1.9468 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.0943 -4.0171 2.8058 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6895 -3.5375 1.6985 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.6653 -5.0931 1.4413 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3031 -3.2001 -1.1847 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.9281 -2.7888 -1.7959 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.5047 -4.4916 -1.2688 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.9035 1.3726 -0.9987 H 0 0 0 0 0 0 0 0 0 0 0 0
-10.8743 0.3945 -2.1157 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.2180 0.8315 -2.6318 H 0 0 0 0 0 0 0 0 0 0 0 0
-10.2577 -2.1414 -2.9239 H 0 0 0 0 0 0 0 0 0 0 0 0
-10.8968 -2.7719 -1.3175 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.2977 -3.3289 -1.9203 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.9083 -1.4617 1.4784 H 0 0 0 0 0 0 0 0 0 0 0 0
-10.5603 -1.8456 0.9687 H 0 0 0 0 0 0 0 0 0 0 0 0
-10.0216 -0.1146 1.1605 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3798 1.4394 1.5828 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8562 0.1496 0.3949 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8431 3.1553 -0.1967 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3662 1.8630 -1.2868 H 0 0 0 0 0 0 0 0 0 0 0 0
6.2736 2.8764 -0.2700 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7118 2.5887 1.3938 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9695 2.8021 2.1389 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9793 4.0796 0.8947 H 0 0 0 0 0 0 0 0 0 0 0 0
9.5592 3.6369 1.7317 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2341 2.4938 -2.4333 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5855 1.9774 -2.0621 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0373 3.6699 -1.6735 H 0 0 0 0 0 0 0 0 0 0 0 0
11.1072 1.4145 0.9496 H 0 0 0 0 0 0 0 0 0 0 0 0
10.9623 0.7748 -0.6949 H 0 0 0 0 0 0 0 0 0 0 0 0
11.2985 2.5668 -0.4144 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7982 1.4904 3.5434 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4714 1.3046 4.1557 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1096 0.4519 4.9830 H 0 0 0 0 0 0 0 0 0 0 0 0
9.0856 0.0422 2.6514 H 0 0 0 0 0 0 0 0 0 0 0 0
8.7989 -1.3861 1.5410 H 0 0 0 0 0 0 0 0 0 0 0 0
9.0488 -1.6238 3.2745 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3702 -2.1210 4.8905 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7848 -3.0985 3.4527 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1256 -2.4631 3.5616 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7523 -3.0282 0.1387 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9479 -2.7563 0.4063 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5324 -3.9172 -0.7810 H 0 0 0 0 0 0 0 0 0 0 0 0
9.0418 -1.9134 -2.7307 H 0 0 0 0 0 0 0 0 0 0 0 0
9.1728 -1.1020 -1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0
8.6217 -0.1492 -2.4824 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7286 -3.0381 -3.6020 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0683 -2.7848 -2.8876 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7729 -1.4980 -3.9172 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