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
-9.0848 1.1062 1.1711 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.6138 0.2388 0.1559 O 0 0 0 0 0 0 0 0 0 0 0 0
-7.2378 0.2025 -0.0535 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.3456 0.9620 0.6747 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.9842 0.9226 0.4637 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4731 0.0965 -0.5108 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.3362 -0.6742 -1.2550 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.6962 -0.6290 -1.0376 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1028 0.0730 -0.7055 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.2546 -0.7952 -0.0373 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7789 -1.5884 0.7785 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8173 -0.8155 -0.2457 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0252 -1.7032 0.4495 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3258 -1.7612 0.2895 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9764 -0.9136 -0.5966 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1769 -0.0218 -1.2944 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1965 0.0373 -1.1319 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3458 -0.9629 -0.7675 O 0 0 0 0 0 0 0 0 0 0 0 0
4.0869 -1.8858 -0.0318 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5602 -1.8885 -0.2622 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1223 -0.6544 0.0537 O 0 0 0 0 0 0 0 0 0 0 0 0
5.9079 0.5555 -0.5362 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1255 0.6550 -1.4966 O 0 0 0 0 0 0 0 0 0 0 0 0
6.5905 1.7355 -0.0481 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3779 2.8939 -0.6215 C 0 0 0 0 0 0 0 0 0 0 0 0
7.5223 1.6350 1.0908 C 0 0 0 0 0 0 0 0 0 0 0 0
-10.1788 0.9820 1.3418 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.5147 0.8593 2.0962 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.8258 2.1735 0.9396 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.7360 1.6194 1.4481 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3166 1.5337 1.0558 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.9194 -1.3304 -2.0304 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.4003 -1.2212 -1.6044 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5188 -2.3846 1.1572 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9050 -2.4841 0.8659 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6725 0.6552 -1.9984 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8110 0.7502 -1.6936 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9360 -1.7059 1.0643 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7258 -2.9354 -0.1978 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0713 -2.6529 0.3789 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8247 -2.2141 -1.3078 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7015 2.9981 -1.4569 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8793 3.7662 -0.2645 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7438 0.5618 1.3368 H 0 0 0 0 0 0 0 0 0 0 0 0
8.4833 2.1070 0.8092 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1069 2.1025 1.9972 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