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
0.9416 -0.2937 0.4239 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5108 -1.4085 0.4313 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0340 -2.6013 -0.2336 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0540 -2.7141 -0.9394 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0718 -1.7593 -1.2686 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0641 -2.1328 -2.0052 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.1286 -0.4462 -0.8847 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1185 0.4761 -1.2073 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5060 0.1150 -0.7391 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4701 1.2051 -1.1598 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.1890 0.6950 -0.5521 Si 0 0 0 0 0 4 0 0 0 0 0 0
-5.9981 0.0054 0.9706 O 0 0 0 0 0 0 0 0 0 0 0 0
-7.0727 0.4220 2.1661 Si 0 0 0 0 0 4 0 0 0 0 0 0
-6.1477 1.2920 3.5631 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.4897 1.4843 1.6878 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.7825 -1.1491 2.9356 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.0918 2.1502 -0.5198 O 0 0 0 0 0 0 0 0 0 0 0 0
-7.9454 2.4845 -1.9293 Si 0 0 0 0 0 4 0 0 0 0 0 0
-9.7845 2.3903 -1.5108 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.6275 4.2959 -2.3615 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.5782 1.3928 -3.3645 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.8286 -0.3124 -1.7398 O 0 0 0 0 0 0 0 0 0 0 0 0
-7.1395 -1.9030 -1.3212 Si 0 0 0 0 0 4 0 0 0 0 0 0
-8.9626 -2.0597 -0.9015 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.0657 -2.6252 -0.0130 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.8896 -2.9462 -2.8807 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7051 -1.4510 1.1573 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1944 -0.3182 1.7996 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5394 0.8323 0.8881 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5835 0.5300 -0.1469 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2226 0.0923 0.5409 Si 0 0 0 0 0 4 0 0 0 0 0 0
7.3122 -0.4479 -0.6735 O 0 0 0 0 0 0 0 0 0 0 0 0
8.9378 -0.2985 -0.2156 Si 0 0 0 0 0 4 0 0 0 0 0 0
9.7941 -1.9463 -0.5366 C 0 0 0 0 0 0 0 0 0 0 0 0
9.1800 0.1240 1.5716 C 0 0 0 0 0 0 0 0 0 0 0 0
9.8425 0.9887 -1.2277 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0570 -1.0711 1.7725 O 0 0 0 0 0 0 0 0 0 0 0 0
6.1081 -2.6778 1.2659 Si 0 0 0 0 0 4 0 0 0 0 0 0
4.8086 -3.7099 2.1629 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9032 -2.9525 -0.5395 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7813 -3.3815 1.7852 C 0 0 0 0 0 0 0 0 0 0 0 0
6.9158 1.5019 1.2134 O 0 0 0 0 0 0 0 0 0 0 0 0
6.8062 2.8765 0.2096 Si 0 0 0 0 0 4 0 0 0 0 0 0
6.8267 2.4991 -1.6025 C 0 0 0 0 0 0 0 0 0 0 0 0
8.3275 3.9436 0.5869 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2919 3.9130 0.6203 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7006 -3.4849 -0.0975 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1905 -3.7648 -1.3522 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1750 0.5041 -2.3346 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8368 1.5059 -0.9220 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8187 -0.8183 -1.2681 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5786 0.0262 0.3628 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1511 2.1632 -0.7400 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.4584 1.2257 -2.2629 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.8883 1.3788 4.3981 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.8742 2.3152 3.2690 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.3046 0.6775 3.9088 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.1906 1.5172 2.5754 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.2505 2.5233 1.4693 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.0785 0.9598 0.9020 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.3084 -0.9379 3.8658 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.8954 -1.8286 3.0893 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.4211 -1.6109 2.1548 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.9524 2.8825 -0.5312 H 0 0 0 0 0 0 0 0 0 0 0 0
-10.1113 1.3401 -1.4932 H 0 0 0 0 0 0 0 0 0 0 0 0
-10.3576 2.9479 -2.2651 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.0344 4.4988 -3.3611 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.5370 4.4825 -2.2968 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.1301 4.9108 -1.5876 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.8806 1.9603 -4.2973 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.2355 0.4815 -3.4119 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.5123 1.1736 -3.4974 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.5196 -1.8394 -1.8612 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.2259 -3.0532 -0.5360 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.2473 -1.2412 -0.2173 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.1864 -2.0448 0.2658 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.6612 -3.6417 -0.3060 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.7249 -2.8775 0.8693 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.7854 -3.0633 -2.9903 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.3020 -3.9528 -2.7474 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.2316 -2.4087 -3.7745 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3498 0.1031 2.4555 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9933 -0.5024 2.5320 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6109 1.2486 0.4391 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8804 1.6454 1.5910 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1419 -0.2688 -0.7932 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6558 1.4156 -0.8316 H 0 0 0 0 0 0 0 0 0 0 0 0
10.3674 -2.2703 0.3430 H 0 0 0 0 0 0 0 0 0 0 0 0
10.5488 -1.8471 -1.3684 H 0 0 0 0 0 0 0 0 0 0 0 0
9.0747 -2.6843 -0.8888 H 0 0 0 0 0 0 0 0 0 0 0 0
10.1007 -0.3415 1.9875 H 0 0 0 0 0 0 0 0 0 0 0 0
8.2865 -0.1067 2.2043 H 0 0 0 0 0 0 0 0 0 0 0 0
9.3329 1.2173 1.6520 H 0 0 0 0 0 0 0 0 0 0 0 0
9.4037 1.1423 -2.2163 H 0 0 0 0 0 0 0 0 0 0 0 0
10.8696 0.6034 -1.3981 H 0 0 0 0 0 0 0 0 0 0 0 0
9.9957 1.9217 -0.6337 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2639 -4.6995 2.3564 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9622 -3.8521 1.4622 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5131 -3.2343 3.1111 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8198 -3.3973 -0.9772 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0975 -3.6951 -0.7579 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6760 -2.0619 -1.1288 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6707 -4.0980 2.6323 H 0 0 0 0 0 0 0 0 0 0 0 0
8.2621 -3.9369 0.9653 H 0 0 0 0 0 0 0 0 0 0 0 0
8.4655 -2.5949 2.1234 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7619 2.8861 -2.0837 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7612 1.4508 -1.8760 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9504 3.0079 -2.0820 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9094 4.0167 -0.3470 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9938 5.0064 0.7865 H 0 0 0 0 0 0 0 0 0 0 0 0
8.8937 3.5491 1.4507 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0474 3.7312 1.6791 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5898 4.9813 0.5033 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4874 3.6539 -0.0660 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