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
1.6656 1.6721 0.2763 O 0 0 0 0 0 0 0 0 0 0 0 0
1.2619 0.4899 0.1415 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0311 0.2200 -0.5187 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4182 -1.0257 -0.6451 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6712 -1.3631 -1.2823 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9832 -2.5859 -1.3715 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5691 -0.4447 -1.8120 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.7592 -0.9798 -2.4153 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5895 0.1447 -2.9169 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.0390 1.1194 -1.8619 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.1108 0.3871 -0.5453 Si 0 0 0 0 0 4 0 0 0 0 0 0
-7.6074 1.2189 -0.3994 O 0 0 0 0 0 0 0 0 0 0 0 0
-7.4892 2.8899 -0.6300 Si 0 0 0 0 0 4 0 0 0 0 0 0
-8.8514 3.6832 0.4134 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.8456 3.3962 -2.4051 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.8704 3.5913 -0.0410 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.2919 0.5672 0.9737 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.8724 -0.5023 2.1529 Si 0 0 0 0 0 4 0 0 0 0 0 0
-5.6634 -2.2751 1.6736 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.8423 -0.2048 3.7075 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.6398 -0.0668 2.5608 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.3314 -1.2722 -0.7896 O 0 0 0 0 0 0 0 0 0 0 0 0
-7.8460 -1.7173 -1.3900 Si 0 0 0 0 0 4 0 0 0 0 0 0
-8.2417 -0.8708 -3.0099 C 0 0 0 0 0 0 0 0 0 0 0 0
-9.2309 -1.4484 -0.1734 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.7848 -3.5668 -1.7575 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0313 -0.5510 0.6088 O 0 0 0 0 0 0 0 0 0 0 0 0
3.2811 -0.2774 1.2298 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9536 -1.5306 1.6691 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3000 -1.2612 2.2702 C 0 0 0 0 0 0 0 0 0 0 0 0
6.5050 -0.4989 1.0558 Si 0 0 0 0 0 4 0 0 0 0 0 0
7.8490 -1.5825 0.9365 O 0 0 0 0 0 0 0 0 0 0 0 0
9.3477 -0.7896 1.1302 Si 0 0 0 0 0 4 0 0 0 0 0 0
9.5321 0.7033 0.0658 C 0 0 0 0 0 0 0 0 0 0 0 0
10.7719 -1.9725 0.8070 C 0 0 0 0 0 0 0 0 0 0 0 0
9.4979 -0.2665 2.9189 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7469 -0.3563 -0.4377 O 0 0 0 0 0 0 0 0 0 0 0 0
5.9368 -1.7161 -1.4202 Si 0 0 0 0 0 4 0 0 0 0 0 0
6.2510 -3.2986 -0.5421 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3588 -1.9132 -2.4488 C 0 0 0 0 0 0 0 0 0 0 0 0
7.3187 -1.4842 -2.6744 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0940 0.9182 1.7402 O 0 0 0 0 0 0 0 0 0 0 0 0
6.4739 2.3774 1.1927 Si 0 0 0 0 0 4 0 0 0 0 0 0
7.6550 3.7199 1.8259 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4245 2.5750 -0.6475 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7948 2.7663 1.9398 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6118 1.0414 -0.8727 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2031 -1.8287 -0.2687 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3068 -1.6039 -1.6986 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4471 -1.6228 -3.2758 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0123 0.7654 -3.6666 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.4605 -0.2421 -3.4994 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.5109 2.0252 -2.3157 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0782 1.5237 -1.4158 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.0541 4.6915 -0.0288 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.4854 3.7375 1.4482 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.7573 3.0365 0.3536 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.8439 3.8674 -2.5169 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.6996 2.5622 -3.1150 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.0904 4.1857 -2.6555 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.0073 4.3597 0.7356 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.1828 2.7936 0.2939 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.4021 4.1382 -0.9106 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.0134 -2.4043 0.7773 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.6597 -2.7311 1.5231 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.1511 -2.8724 2.4826 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.7322 -1.1334 4.2872 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8548 0.1925 3.4574 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.3523 0.5393 4.3645 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.1031 0.5218 1.7728 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.6997 0.5354 3.5047 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.2163 -0.9968 2.7610 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.6372 -1.2719 -3.8467 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.1174 0.2201 -2.8567 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.3008 -1.0228 -3.2887 H 0 0 0 0 0 0 0 0 0 0 0 0
-10.1550 -1.8777 -0.6529 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.4384 -0.3813 0.0022 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.0155 -2.0242 0.7428 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.9428 -3.7580 -2.4621 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.7134 -3.8183 -2.3432 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.6672 -4.1523 -0.8461 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0222 0.3459 2.1396 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8673 0.3456 0.5622 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9726 -2.3053 0.8699 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2743 -1.9794 2.4599 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6700 -2.2513 2.6470 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1867 -0.6269 3.1761 H 0 0 0 0 0 0 0 0 0 0 0 0
8.7234 0.8050 -0.6912 H 0 0 0 0 0 0 0 0 0 0 0 0
9.6561 1.6244 0.6677 H 0 0 0 0 0 0 0 0 0 0 0 0
10.4652 0.6051 -0.5239 H 0 0 0 0 0 0 0 0 0 0 0 0
10.9764 -2.0086 -0.2854 H 0 0 0 0 0 0 0 0 0 0 0 0
10.5481 -2.9796 1.2353 H 0 0 0 0 0 0 0 0 0 0 0 0
11.7045 -1.6205 1.2943 H 0 0 0 0 0 0 0 0 0 0 0 0
10.5773 -0.1134 3.1277 H 0 0 0 0 0 0 0 0 0 0 0 0
8.8770 0.5856 3.1870 H 0 0 0 0 0 0 0 0 0 0 0 0
9.1962 -1.1573 3.5419 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1248 -3.8772 -0.9698 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3819 -3.9985 -0.7329 H 0 0 0 0 0 0 0 0 0 0 0 0
6.2905 -3.2329 0.5620 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4820 -2.8613 -3.0119 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5118 -2.0472 -1.7653 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2494 -1.0778 -3.1466 H 0 0 0 0 0 0 0 0 0 0 0 0
7.8300 -0.5170 -2.4745 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9594 -1.5524 -3.7195 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0988 -2.2660 -2.5775 H 0 0 0 0 0 0 0 0 0 0 0 0
8.6373 3.2735 2.0749 H 0 0 0 0 0 0 0 0 0 0 0 0
7.2616 4.1155 2.8028 H 0 0 0 0 0 0 0 0 0 0 0 0
7.8295 4.4948 1.0806 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8512 3.5304 -0.8409 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8899 1.8069 -1.1949 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4501 2.8056 -1.0048 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0045 2.7868 1.1773 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8542 3.7319 2.4767 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6213 2.0028 2.7312 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