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
2.2036 2.9981 -2.5316 O 0 0 0 0 0 0 0 0 0 0 0 0
1.3192 2.1528 -2.1524 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0892 2.0720 -2.8797 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9560 1.3256 -2.7085 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1998 0.3294 -1.7112 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3711 0.0458 -0.8395 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.4024 -0.3829 -1.6684 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.7279 -1.3638 -0.7238 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7544 -0.7395 0.6485 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8025 0.3823 0.6417 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.4792 -0.3717 0.2488 Si 0 0 0 0 0 4 0 0 0 0 0 0
-5.4053 -1.9762 0.9129 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.6292 -2.9879 0.3321 Si 0 0 0 0 0 4 0 0 0 0 0 0
-6.3517 -4.6828 1.0821 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.2679 -2.3685 0.9573 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.6180 -3.1941 -1.5157 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.7508 0.4488 0.9882 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.3203 1.7050 2.0342 Si 0 0 0 0 0 4 0 0 0 0 0 0
-5.5087 1.1259 3.5870 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.2584 3.0163 1.2488 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.9447 2.5586 2.5075 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.6127 -0.5069 -1.4256 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.8332 0.3874 -2.1588 Si 0 0 0 0 0 4 0 0 0 0 0 0
-6.9105 -0.1588 -3.9693 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.5243 0.1367 -1.4618 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.4587 2.2322 -2.2246 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6323 1.3914 -1.0721 O 0 0 0 0 0 0 0 0 0 0 0 0
2.8406 1.4482 -0.3248 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8569 0.4456 0.7767 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1048 0.4537 1.6046 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6597 0.0399 0.6980 Si 0 0 0 0 0 4 0 0 0 0 0 0
6.8831 1.1554 1.1271 O 0 0 0 0 0 0 0 0 0 0 0 0
6.9271 2.5555 0.1853 Si 0 0 0 0 0 4 0 0 0 0 0 0
5.7636 3.8867 0.8016 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6720 3.2668 0.3655 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6704 2.2507 -1.6318 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3797 -0.0851 -0.9607 O 0 0 0 0 0 0 0 0 0 0 0 0
5.2056 -1.6687 -1.5413 Si 0 0 0 0 0 4 0 0 0 0 0 0
6.8157 -2.2727 -2.2817 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6333 -2.8782 -0.2705 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9420 -1.6435 -2.9366 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2354 -1.5120 1.2224 O 0 0 0 0 0 0 0 0 0 0 0 0
7.7675 -1.4292 1.9403 Si 0 0 0 0 0 4 0 0 0 0 0 0
8.1753 -3.1647 2.5517 C 0 0 0 0 0 0 0 0 0 0 0 0
9.0995 -0.9535 0.7070 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7830 -0.2830 3.4091 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0362 2.7920 -3.7539 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7850 1.4715 -3.4320 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7356 -1.8042 -0.9488 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9429 -2.1461 -0.7977 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7618 -0.3265 0.8779 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0296 -1.4991 1.4276 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7655 0.8478 1.6254 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4748 1.0478 -0.1982 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.2688 -4.9486 0.9630 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.7018 -4.7372 2.1224 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.9190 -5.4139 0.4708 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.1528 -1.3618 1.4479 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.6918 -3.0289 1.7621 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.0242 -2.2779 0.1570 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.5886 -2.8119 -1.9235 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.6101 -4.2826 -1.8218 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.7354 -2.7601 -2.0108 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5230 1.6525 3.7426 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.1130 1.4332 4.4899 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.4113 0.0231 3.6538 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.7426 4.0361 1.2670 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2937 3.1773 1.8044 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.0057 2.8298 0.2070 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.7354 3.5843 2.8807 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.5294 1.9424 3.2057 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.5393 2.6673 1.5774 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.9627 -1.2545 -4.0443 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.7807 0.3417 -4.4355 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.9632 0.1557 -4.4490 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.9696 -0.8546 -1.7723 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.6073 0.1881 -0.3777 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.2140 0.8869 -1.9505 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.8404 2.7558 -1.3329 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.3942 2.4169 -2.4394 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.0327 2.6585 -3.0876 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7251 1.3976 -0.9374 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7972 2.4613 0.1837 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9835 0.6260 1.4451 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6549 -0.5807 0.3528 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2312 1.4462 2.1253 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9712 -0.2995 2.4267 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7665 3.7907 0.3563 H 0 0 0 0 0 0 0 0 0 0 0 0
6.2302 4.8716 0.5105 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7676 3.8428 1.8966 H 0 0 0 0 0 0 0 0 0 0 0 0
8.6997 4.3061 -0.0065 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9988 3.1947 1.4313 H 0 0 0 0 0 0 0 0 0 0 0 0
9.3573 2.6549 -0.2332 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6146 2.4674 -1.9404 H 0 0 0 0 0 0 0 0 0 0 0 0
7.0272 1.2609 -1.9529 H 0 0 0 0 0 0 0 0 0 0 0 0
7.2807 3.0068 -2.2099 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5674 -2.4655 -1.5031 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1531 -1.5236 -3.0168 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5898 -3.2106 -2.8211 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4731 -3.5618 0.0030 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1695 -2.4165 0.6206 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8536 -3.5493 -0.7019 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9912 -0.6913 -3.5075 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9068 -1.8277 -2.5383 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1998 -2.4629 -3.6377 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2527 -3.3166 2.6220 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7244 -3.2746 3.5594 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 -3.8953 1.8459 H 0 0 0 0 0 0 0 0 0 0 0 0
8.7094 -0.2852 -0.0874 H 0 0 0 0 0 0 0 0 0 0 0 0
9.9335 -0.5041 1.2856 H 0 0 0 0 0 0 0 0 0 0 0 0
9.4509 -1.8673 0.1894 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5072 0.5298 3.1935 H 0 0 0 0 0 0 0 0 0 0 0 0
8.1492 -0.8055 4.3159 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7675 0.0938 3.6563 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