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
-8.3904 2.1097 -1.5475 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.0900 0.9619 -0.7796 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.7744 0.5968 -0.4880 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.7439 1.3786 -0.9630 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4100 1.0553 -0.6983 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1333 -0.0599 0.0470 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.1372 -0.8575 0.5334 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.4657 -0.5126 0.2547 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8218 -0.3828 0.3106 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1148 -1.2042 -0.5521 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7150 -1.6336 -1.5685 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7284 -1.5371 -0.2603 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0102 -2.3641 -1.1252 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2751 -2.6511 -0.8222 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9419 -2.1634 0.3226 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2017 -1.3612 1.1382 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1291 -1.0334 0.8710 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2251 -2.4914 0.5672 O 0 0 0 0 0 0 0 0 0 0 0 0
4.0501 -2.1139 1.5728 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4353 -0.6720 1.6813 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1211 -0.2356 0.4892 O 0 0 0 0 0 0 0 0 0 0 0 0
5.5479 1.0960 0.4365 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2999 1.8289 1.4466 O 0 0 0 0 0 0 0 0 0 0 0 0
6.2447 1.6406 -0.7087 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4984 0.8797 -1.7492 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6684 3.0422 -0.7094 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.7750 2.0710 -2.4930 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.1230 3.0395 -1.0040 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.4379 2.0861 -1.8847 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.9777 2.2512 -1.5468 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6088 1.6683 -1.0710 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.9610 -1.7446 1.1246 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.2307 -1.1494 0.6445 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5396 -2.7299 -2.0009 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8492 -3.2886 -1.4771 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6050 -0.9621 2.0392 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6673 -0.3915 1.5535 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0403 -2.6644 1.4178 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6851 -2.4048 2.5966 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6012 0.0025 1.7903 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1396 -0.5003 2.5479 H 0 0 0 0 0 0 0 0 0 0 0 0
7.0110 1.2149 -2.6343 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1782 -0.1493 -1.7291 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7331 3.1862 -0.3873 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0565 3.6987 -0.0644 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5766 3.4505 -1.7513 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