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
-8.9359 2.4108 0.6289 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.5789 1.1605 0.0435 O 0 0 0 0 0 0 0 0 0 0 0 0
-7.2163 0.8702 -0.1406 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.2487 1.7735 0.2359 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.9205 1.4911 0.0567 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5419 0.3026 -0.5011 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.4650 -0.6144 -0.8855 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.8106 -0.3200 -0.7001 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1562 0.0952 -0.6482 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.3873 -0.4917 0.3195 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9533 -0.8567 1.3796 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.9500 -0.7175 0.1908 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2493 -0.3486 -0.9371 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1060 -0.5731 -1.0330 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8297 -1.1725 -0.0178 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1125 -1.5330 1.0987 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2463 -1.3156 1.2119 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1891 -1.3990 -0.1107 O 0 0 0 0 0 0 0 0 0 0 0 0
3.8374 -2.0139 0.9697 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2968 -2.2363 0.8298 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0998 -1.1346 0.6475 O 0 0 0 0 0 0 0 0 0 0 0 0
6.0277 -0.3072 -0.4409 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2023 -0.5145 -1.3710 O 0 0 0 0 0 0 0 0 0 0 0 0
6.9263 0.8356 -0.5211 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8492 1.6237 -1.5697 C 0 0 0 0 0 0 0 0 0 0 0 0
7.8904 1.0648 0.5806 C 0 0 0 0 0 0 0 0 0 0 0 0
-9.9973 2.4624 0.8777 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.5637 3.2325 -0.0066 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.3869 2.4837 1.6129 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.5890 2.7143 0.6788 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1927 2.2307 0.3674 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.1657 -1.5489 -1.3241 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.5741 -1.0196 -0.9912 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7532 0.1254 -1.7701 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6912 -0.2900 -1.9194 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6290 -2.0103 1.9349 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7461 -1.6345 2.1404 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6015 -1.3579 1.8636 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2691 -2.9462 1.1803 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4168 -2.9748 -0.0238 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6052 -2.8527 1.7322 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5051 2.4727 -1.6457 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1462 1.4531 -2.3689 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3110 2.0824 0.4437 H 0 0 0 0 0 0 0 0 0 0 0 0
8.7298 0.3510 0.5552 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3570 0.9471 1.5474 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