Monomers
Trimethoxy(4-vinylphenyl)silane
Identifiers
IUPAC name
(4-ethenylphenyl)-trimethoxysilane
InchI
InChI=1S/C11H16O3Si/c1-5-10-6-8-11(9-7-10)15(12-2,13-3)14-4/h5-9H,1H2,2-4H3
InchI Key
LTQBNYCMVZQRSD-UHFFFAOYSA-N
SMILES
CO[Si](c1ccc(cc1)C=C)(OC)OC
Canonical SMILES
CO[Si](C1=CC=C(C=C1)C=C)(OC)OC
Isomeric SMILES
CO[Si](C1=CC=C(C=C1)C=C)(OC)OC
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C11H16O3Si
Heavy Atom Count
15
Molecular Weight
224.332
Exact Molecular Weight
224.0869
Valence Electrons
82
Radical Electrons
0
tPSA
27.69
MolLogP
1.4147
H Bond Acceptors
3
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
1
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
1
MOL File
RDKit 3D
31 31 0 0 0 0 0 0 0 0999 V2000
-2.8080 2.0579 -0.4712 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1673 1.5043 0.6348 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.4985 -0.0256 0.2988 Si 0 0 0 0 0 4 0 0 0 0 0 0
0.2991 0.1316 0.0209 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1252 -0.9631 0.1668 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4800 -0.7727 -0.0595 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0110 0.4506 -0.4175 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1324 1.5351 -0.5539 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8079 1.3685 -0.3373 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4317 0.6498 -0.6547 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2975 -0.3140 -0.5449 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2230 -0.7898 -1.0270 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.4081 -2.1268 -0.7655 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7699 -1.0168 1.6921 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.9753 -0.6327 2.3028 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6336 1.3989 -0.7955 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2698 3.0082 -0.1224 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1185 2.3051 -1.2925 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7035 -1.9201 0.4477 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0909 -1.6551 0.0655 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5620 2.4935 -0.8362 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1471 2.2316 -0.4511 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7556 1.6431 -0.9310 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3508 -0.0807 -0.7409 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9945 -1.3148 -0.2697 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5018 -2.7188 -1.7153 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3340 -2.3374 -0.1900 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5770 -2.5938 -0.2074 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7152 0.0076 3.1548 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5922 -1.5148 2.5878 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5971 -0.0089 1.6179 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 1 0
4 5 2 0
5 6 1 0
6 7 2 0
7 8 1 0
8 9 2 0
7 10 1 0
10 11 2 3
3 12 1 0
12 13 1 0
3 14 1 0
14 15 1 0
9 4 1 0
1 16 1 0
1 17 1 0
1 18 1 0
5 19 1 0
6 20 1 0
8 21 1 0
9 22 1 0
10 23 1 0
11 24 1 0
11 25 1 0
13 26 1 0
13 27 1 0
13 28 1 0
15 29 1 0
15 30 1 0
15 31 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers