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
2.4848 1.1735 -0.4521 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7731 0.7132 0.4737 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3239 0.9304 0.3841 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2260 1.5618 -0.6107 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6813 1.7463 -0.6399 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2516 2.3478 -1.5987 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.4971 1.2755 0.3733 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.8990 1.4583 0.3288 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5663 0.8854 1.5624 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.0628 1.0732 1.5016 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.8340 0.2057 0.0380 Si 0 0 0 0 0 4 0 0 0 0 0 0
-8.4834 -0.0402 0.4008 O 0 0 0 0 0 0 0 0 0 0 0 0
-9.3998 1.3754 0.5058 Si 0 0 0 0 0 4 0 0 0 0 0 0
-11.2123 0.8604 0.3659 C 0 0 0 0 0 0 0 0 0 0 0 0
-9.2103 2.2596 2.1358 C 0 0 0 0 0 0 0 0 0 0 0 0
-9.0792 2.5515 -0.9163 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.1136 -1.3522 -0.0334 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.9252 -2.4516 1.0027 Si 0 0 0 0 0 4 0 0 0 0 0 0
-6.7925 -1.9218 2.7849 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.7407 -2.6099 0.5241 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.1545 -4.1350 0.7420 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.5770 1.1293 -1.3462 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.5710 0.2260 -2.7931 Si 0 0 0 0 0 4 0 0 0 0 0 0
-8.2770 -0.2981 -3.3320 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.8677 1.3237 -4.1356 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.4843 -1.2831 -2.6716 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3435 0.0365 1.5178 O 0 0 0 0 0 0 0 0 0 0 0 0
3.7348 -0.1817 1.6217 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5083 1.1067 1.7080 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9797 0.8510 1.8235 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6913 -0.0678 0.3665 Si 0 0 0 0 0 4 0 0 0 0 0 0
6.1756 -1.6906 0.4460 O 0 0 0 0 0 0 0 0 0 0 0 0
7.1808 -2.7014 1.3588 Si 0 0 0 0 0 4 0 0 0 0 0 0
8.9806 -2.4858 0.9107 C 0 0 0 0 0 0 0 0 0 0 0 0
6.7410 -4.4798 0.9016 C 0 0 0 0 0 0 0 0 0 0 0 0
6.9070 -2.5305 3.1904 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1087 0.6571 -1.0559 O 0 0 0 0 0 0 0 0 0 0 0 0
6.7924 0.0611 -2.4832 Si 0 0 0 0 0 4 0 0 0 0 0 0
6.1860 1.1606 -3.8943 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2297 -1.6767 -2.8899 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6602 0.1745 -2.5065 C 0 0 0 0 0 0 0 0 0 0 0 0
8.3827 0.0819 0.4204 O 0 0 0 0 0 0 0 0 0 0 0 0
8.8483 1.6311 0.9195 Si 0 0 0 0 0 4 0 0 0 0 0 0
7.8271 3.0049 0.2373 C 0 0 0 0 0 0 0 0 0 0 0 0
10.6265 1.9328 0.3534 C 0 0 0 0 0 0 0 0 0 0 0 0
8.8783 1.7517 2.7948 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2799 0.5422 1.1853 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3454 1.9637 -1.4297 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2416 1.0094 -0.6087 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1292 2.5519 0.3160 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1657 1.4387 2.4277 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2787 -0.1806 1.7219 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.2075 2.1888 1.3803 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.5426 0.7691 2.4435 H 0 0 0 0 0 0 0 0 0 0 0 0
-11.7616 1.7427 -0.0025 H 0 0 0 0 0 0 0 0 0 0 0 0
-11.5704 0.5815 1.3779 H 0 0 0 0 0 0 0 0 0 0 0 0
-11.3350 -0.0120 -0.2901 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.3587 2.9758 2.0766 H 0 0 0 0 0 0 0 0 0 0 0 0
-10.1741 2.8054 2.3225 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.0680 1.5031 2.9442 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.1950 2.0164 -1.8674 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.0651 2.9574 -0.7854 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.8432 3.3593 -0.9137 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.8450 -2.8337 3.4398 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.6318 -1.2704 3.0880 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.8296 -1.4391 3.0293 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.8394 -2.2822 -0.5124 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.3831 -2.0588 1.2420 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.0568 -3.6712 0.5662 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.7019 -4.8978 1.3687 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.0703 -4.1336 0.9812 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.3233 -4.4208 -0.3004 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.6628 0.4072 -4.0810 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.9505 -0.4753 -2.4903 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.1760 -1.2778 -3.8609 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.1455 0.9674 -5.1398 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.7623 1.3506 -3.9780 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.2115 2.3759 -4.0055 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.2026 -1.5558 -3.7313 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5436 -1.0942 -2.1502 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.0445 -2.1597 -2.2855 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8843 -0.7728 2.5410 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1009 -0.7160 0.7170 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3617 1.7463 0.8086 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1917 1.6383 2.6329 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5383 1.7975 2.0213 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1195 0.2320 2.7451 H 0 0 0 0 0 0 0 0 0 0 0 0
9.4892 -1.7152 1.5044 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9891 -2.2464 -0.1919 H 0 0 0 0 0 0 0 0 0 0 0 0
9.5098 -3.4542 1.0355 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4341 -5.1984 1.3873 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9484 -4.5811 -0.2023 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6905 -4.6992 1.0784 H 0 0 0 0 0 0 0 0 0 0 0 0
7.0643 -3.5064 3.6606 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4855 -1.7132 3.6354 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8201 -2.2711 3.3377 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2042 0.8013 -4.2655 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9100 1.0056 -4.7234 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1532 2.2215 -3.5694 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5625 -2.4203 -2.1667 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1200 -1.6338 -3.0225 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7417 -1.9448 -3.8591 H 0 0 0 0 0 0 0 0 0 0 0 0
9.1453 -0.4123 -1.7301 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9243 1.2412 -2.3554 H 0 0 0 0 0 0 0 0 0 0 0 0
9.0151 -0.2096 -3.4850 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3920 3.6332 -0.5148 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5927 3.7172 1.0535 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8500 2.6885 -0.1811 H 0 0 0 0 0 0 0 0 0 0 0 0
10.6817 1.7469 -0.7195 H 0 0 0 0 0 0 0 0 0 0 0 0
10.8254 3.0147 0.5088 H 0 0 0 0 0 0 0 0 0 0 0 0
11.3109 1.2920 0.9495 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3688 0.8783 3.2671 H 0 0 0 0 0 0 0 0 0 0 0 0
9.9139 1.7318 3.1991 H 0 0 0 0 0 0 0 0 0 0 0 0
8.4544 2.7239 3.1305 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