Monomers
4-[2-(Methacryloyloxy)ethoxy]benzoic acid 4-methoxyphenyl ester
Identifiers
IUPAC name
(4-methoxyphenyl) 4-[2-(2-methylprop-2-enoyloxy)ethoxy]benzoate
InchI
InChI=1S/C20H20O6/c1-14(2)19(21)25-13-12-24-17-6-4-15(5-7-17)20(22)26-18-10-8-16(23-3)9-11-18/h4-11H,1,12-13H2,2-3H3
InchI Key
OIRKPCZRJHIGSG-UHFFFAOYSA-N
SMILES
COc1ccc(cc1)OC(=O)c1ccc(cc1)OCCOC(=O)C(=C)C
Canonical SMILES
CC(=C)C(=O)OCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)OC
Isomeric SMILES
CC(=C)C(=O)OCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)OC
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C20H20O6
Heavy Atom Count
26
Molecular Weight
356.374
Exact Molecular Weight
356.126
Valence Electrons
136
Radical Electrons
0
tPSA
71.06
MolLogP
3.4125
H Bond Acceptors
6
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
2
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
2
MOL File
RDKit 3D
46 47 0 0 0 0 0 0 0 0999 V2000
9.3553 -0.1846 1.1215 C 0 0 0 0 0 0 0 0 0 0 0 0
8.3098 -0.6396 1.9599 O 0 0 0 0 0 0 0 0 0 0 0 0
6.9906 -0.6833 1.5317 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6483 -0.2797 0.2584 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3379 -0.3136 -0.1938 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3253 -0.7583 0.6291 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6517 -1.1624 1.8971 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9682 -1.1252 2.3425 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0393 -0.7635 0.1068 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2008 0.3300 0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6536 1.3317 0.8252 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8489 0.3508 -0.3141 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0576 1.4695 -0.1674 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2203 1.5363 -0.6563 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7704 0.4424 -1.3353 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9912 -0.6782 -1.4878 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2880 -0.7157 -0.9861 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0647 0.4973 -1.8359 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.8171 1.6800 -1.6467 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.1880 1.5805 -2.2427 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.8871 0.5167 -1.6423 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.1853 0.4415 -0.3098 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.8301 1.3674 0.4650 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.9220 -0.7075 0.2613 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.2922 -1.6720 -0.5446 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.2306 -0.7676 1.6901 C 0 0 0 0 0 0 0 0 0 0 0 0
9.2571 0.8989 0.8877 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2289 -0.7135 0.1316 H 0 0 0 0 0 0 0 0 0 0 0 0
10.3396 -0.4739 1.4892 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4280 0.0750 -0.4095 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1639 0.0219 -1.2062 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8618 -1.5141 2.5526 H 0 0 0 0 0 0 0 0 0 0 0 0
6.2357 -1.4448 3.3495 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4790 2.3288 0.3618 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8218 2.4312 -0.5262 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3679 -1.5424 -2.0008 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9029 -1.5978 -1.1055 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2538 2.5548 -2.0926 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8382 1.8862 -0.5619 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.7914 2.5032 -1.9957 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.1558 1.5053 -3.3421 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.0672 -1.6274 -1.5841 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.8294 -2.5143 -0.1408 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.4791 -0.2904 2.3418 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.1932 -0.2401 1.8863 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.3757 -1.8300 2.0153 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 2 0
4 5 1 0
5 6 2 0
6 7 1 0
7 8 2 0
6 9 1 0
9 10 1 0
10 11 2 0
10 12 1 0
12 13 2 0
13 14 1 0
14 15 2 0
15 16 1 0
16 17 2 0
15 18 1 0
18 19 1 0
19 20 1 0
20 21 1 0
21 22 1 0
22 23 2 0
22 24 1 0
24 25 2 3
24 26 1 0
8 3 1 0
17 12 1 0
1 27 1 0
1 28 1 0
1 29 1 0
4 30 1 0
5 31 1 0
7 32 1 0
8 33 1 0
13 34 1 0
14 35 1 0
16 36 1 0
17 37 1 0
19 38 1 0
19 39 1 0
20 40 1 0
20 41 1 0
25 42 1 0
25 43 1 0
26 44 1 0
26 45 1 0
26 46 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers