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
9.4625 0.6207 -1.8011 C 0 0 0 0 0 0 0 0 0 0 0 0
8.8703 -0.0647 -0.7398 O 0 0 0 0 0 0 0 0 0 0 0 0
7.5024 -0.2370 -0.6019 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6599 0.2904 -1.5554 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2770 0.1176 -1.4182 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7498 -0.5720 -0.3433 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5910 -1.0952 0.6032 C 0 0 0 0 0 0 0 0 0 0 0 0
6.9580 -0.9214 0.4627 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3804 -0.7286 -0.2311 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5538 0.1557 0.4250 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0873 1.1630 0.9500 O 0 0 0 0 0 0 0 0 0 0 0 0
1.1175 -0.0088 0.5424 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4345 -1.0785 0.0024 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9316 -1.1829 0.1453 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6831 -0.2235 0.8350 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9858 0.8369 1.3673 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3763 0.9354 1.2214 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0368 -0.3627 0.9551 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.7983 0.5922 1.6436 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.2615 0.2740 1.6724 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.8251 0.1922 0.3747 O 0 0 0 0 0 0 0 0 0 0 0 0
-7.1689 -0.0925 0.1691 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.8551 -0.2733 1.2072 O 0 0 0 0 0 0 0 0 0 0 0 0
-7.7668 -0.1809 -1.1528 C 0 0 0 0 0 0 0 0 0 0 0 0
-9.0488 -0.4556 -1.2453 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.0099 0.0216 -2.4022 C 0 0 0 0 0 0 0 0 0 0 0 0
9.0001 0.3806 -2.7846 H 0 0 0 0 0 0 0 0 0 0 0 0
10.5413 0.3910 -1.8855 H 0 0 0 0 0 0 0 0 0 0 0 0
9.3584 1.7133 -1.6021 H 0 0 0 0 0 0 0 0 0 0 0 0
7.0487 0.8365 -2.4094 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6345 0.5396 -2.1781 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1754 -1.6243 1.4269 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6524 -1.3233 1.1949 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0223 -1.8242 -0.5342 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4106 -2.0396 -0.2974 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5043 1.6037 1.9061 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8953 1.8001 1.6630 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5697 1.6004 1.2834 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4556 0.5721 2.7200 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.4718 -0.6157 2.2940 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.7736 1.1284 2.1781 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.6592 -0.6148 -0.3740 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.5700 -0.5389 -2.2011 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.6997 0.4444 -3.1884 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.6295 -0.9231 -2.8242 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.2331 0.7714 -2.2344 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