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
-1.0559 -0.4048 -1.3018 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0464 0.1240 -0.1727 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1206 0.9315 0.2171 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1328 1.0841 -0.5986 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3025 1.8696 -0.2633 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3355 2.4364 0.8596 O 0 0 0 0 0 0 0 0 0 0 0 0
3.3764 2.0209 -1.1226 O 0 0 0 0 0 0 0 0 0 0 0 0
4.5148 2.7941 -0.7993 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5205 2.7149 -1.9520 C 0 0 0 0 0 0 0 0 0 0 0 0
5.8779 1.2424 -2.0768 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6407 0.6102 -0.4958 Si 0 0 0 0 0 4 0 0 0 0 0 0
7.7601 -0.6507 -0.8010 O 0 0 0 0 0 0 0 0 0 0 0 0
7.1024 -1.9649 -1.6414 Si 0 0 0 0 0 4 0 0 0 0 0 0
8.0500 -3.5070 -1.1003 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3184 -2.2722 -1.1740 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2893 -1.8230 -3.4869 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3924 0.0568 0.5137 O 0 0 0 0 0 0 0 0 0 0 0 0
5.8199 0.0618 2.1687 Si 0 0 0 0 0 4 0 0 0 0 0 0
6.0164 1.7960 2.8277 C 0 0 0 0 0 0 0 0 0 0 0 0
7.3653 -0.9202 2.4235 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4310 -0.7542 3.1169 C 0 0 0 0 0 0 0 0 0 0 0 0
7.5303 1.8936 0.2118 O 0 0 0 0 0 0 0 0 0 0 0 0
9.1209 2.0154 -0.4055 Si 0 0 0 0 0 4 0 0 0 0 0 0
9.7344 3.7438 0.0010 C 0 0 0 0 0 0 0 0 0 0 0 0
10.2036 0.7419 0.4113 C 0 0 0 0 0 0 0 0 0 0 0 0
9.1730 1.8566 -2.2659 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1016 -0.0500 0.6747 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.2503 -0.7888 0.3846 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9485 -0.1467 -0.7681 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.2153 -0.8413 -1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.3943 -0.8618 0.2402 Si 0 0 0 0 0 4 0 0 0 0 0 0
-8.0012 -0.7320 -0.1828 O 0 0 0 0 0 0 0 0 0 0 0 0
-8.4224 -0.8114 -1.8006 Si 0 0 0 0 0 4 0 0 0 0 0 0
-7.6003 -2.1703 -2.7419 C 0 0 0 0 0 0 0 0 0 0 0 0
-10.2827 -1.1914 -1.8398 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.2515 0.7802 -2.7447 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.1247 -2.3473 1.0510 O 0 0 0 0 0 0 0 0 0 0 0 0
-7.3908 -2.7504 2.0854 Si 0 0 0 0 0 4 0 0 0 0 0 0
-7.1208 -4.4604 2.8282 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.5395 -1.5080 3.4878 C 0 0 0 0 0 0 0 0 0 0 0 0
-9.0275 -2.8365 1.1939 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.9052 0.3770 1.3303 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.8580 1.7708 1.2615 Si 0 0 0 0 0 4 0 0 0 0 0 0
-8.6747 1.3620 1.3356 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.5038 2.8797 -0.1735 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.4647 2.7665 2.8246 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1617 1.4072 1.1732 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1055 0.6068 -1.5707 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1976 3.8651 -0.6756 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9485 2.4914 0.1590 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0760 3.0939 -2.8741 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4263 3.2526 -1.6367 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5027 1.0263 -2.9518 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8978 0.7271 -2.2813 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5495 -4.4019 -1.5203 H 0 0 0 0 0 0 0 0 0 0 0 0
9.0575 -3.4108 -1.5478 H 0 0 0 0 0 0 0 0 0 0 0 0
8.1635 -3.5151 -0.0131 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9875 -3.2859 -1.5173 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2002 -2.2754 -0.0770 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6231 -1.5500 -1.6085 H 0 0 0 0 0 0 0 0 0 0 0 0
6.2572 -1.6992 -3.9068 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7021 -2.7357 -3.9133 H 0 0 0 0 0 0 0 0 0 0 0 0
7.8392 -0.9045 -3.7785 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1997 2.4589 2.5455 H 0 0 0 0 0 0 0 0 0 0 0 0
7.0182 2.1675 2.5171 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0319 1.7475 3.9392 H 0 0 0 0 0 0 0 0 0 0 0 0
8.1966 -0.2067 2.6053 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5530 -1.6011 1.5958 H 0 0 0 0 0 0 0 0 0 0 0 0
7.2463 -1.5785 3.3338 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6425 -0.7281 4.2250 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2327 -1.7762 2.7620 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4937 -0.1446 3.0116 H 0 0 0 0 0 0 0 0 0 0 0 0
10.7961 3.8218 -0.2756 H 0 0 0 0 0 0 0 0 0 0 0 0
9.6176 3.9677 1.0936 H 0 0 0 0 0 0 0 0 0 0 0 0
9.1141 4.4658 -0.5473 H 0 0 0 0 0 0 0 0 0 0 0 0
11.0743 0.4514 -0.2148 H 0 0 0 0 0 0 0 0 0 0 0 0
10.6129 1.1543 1.3735 H 0 0 0 0 0 0 0 0 0 0 0 0
9.6429 -0.1741 0.6862 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3894 2.4683 -2.7475 H 0 0 0 0 0 0 0 0 0 0 0 0
10.1525 2.2615 -2.6079 H 0 0 0 0 0 0 0 0 0 0 0 0
9.0480 0.8183 -2.6108 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0226 -1.8431 0.0927 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9057 -0.8161 1.2786 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2797 0.8689 -0.3938 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2835 0.0835 -1.6219 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.5894 -0.3253 -2.0855 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.9878 -1.8932 -1.5482 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.1074 -2.9257 -2.0944 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.3308 -2.7384 -3.3680 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.8631 -1.7762 -3.5009 H 0 0 0 0 0 0 0 0 0 0 0 0
-10.4423 -2.2265 -1.5443 H 0 0 0 0 0 0 0 0 0 0 0 0
-10.7302 -0.5278 -1.0498 H 0 0 0 0 0 0 0 0 0 0 0 0
-10.6720 -0.9124 -2.8405 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.2747 1.2649 -2.6400 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.0899 1.4743 -2.5287 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.3329 0.5031 -3.8366 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.0860 -4.7687 3.2728 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.2785 -4.4780 3.5258 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.9638 -5.1323 1.9416 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.3447 -2.0251 4.4653 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.5608 -1.1024 3.5624 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.7930 -0.7202 3.3940 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.5439 -1.8825 1.1103 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.8273 -3.3465 0.2213 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.7016 -3.5189 1.7993 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.2132 2.0440 2.0531 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.1593 1.5760 0.3490 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.8774 0.3379 1.6896 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.4842 3.2858 -0.5612 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.9161 3.7986 0.1207 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.9722 2.4216 -1.0070 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.2238 3.5582 2.9396 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.4688 3.2350 2.6196 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.3808 2.1049 3.7049 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