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
8.9820 1.8242 -0.5385 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1428 1.4244 0.5357 O 0 0 0 0 0 0 0 0 0 0 0 0
6.8022 1.1379 0.3534 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1900 1.2204 -0.8785 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8515 0.9292 -1.0322 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1173 0.5493 0.0686 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7178 0.4643 1.2989 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0457 0.7565 1.4337 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7457 0.2423 -0.0431 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3665 -1.0578 -0.3105 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2688 -1.9115 -0.4426 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9731 -1.4345 -0.4366 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0598 -0.5422 -0.3019 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3886 -0.9394 -0.4294 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7424 -2.2357 -0.6935 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6781 -3.1502 -0.8323 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6180 -2.7374 -0.7037 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0345 -2.6941 -0.8240 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.1528 -1.8933 -0.6496 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2927 -1.4434 0.7856 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.4368 -0.6054 0.9727 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.6357 0.5954 0.3589 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.7784 1.0460 -0.4387 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.8484 1.3917 0.6098 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.7561 0.9117 1.4560 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.0774 2.6918 -0.0465 C 0 0 0 0 0 0 0 0 0 0 0 0
8.7898 1.1161 -1.3935 H 0 0 0 0 0 0 0 0 0 0 0 0
10.0512 1.7460 -0.2613 H 0 0 0 0 0 0 0 0 0 0 0 0
8.7374 2.8376 -0.9128 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8188 1.5260 -1.7137 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4076 1.0024 -1.9977 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1330 0.1668 2.1482 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4988 0.6857 2.3981 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1629 0.5042 -0.0898 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1684 -0.1785 -0.3484 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9506 -4.1866 -1.0444 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3970 -3.5119 -0.8257 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1327 -0.9804 -1.3135 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.0834 -2.4265 -0.9634 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3843 -1.0567 1.2486 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5338 -2.3808 1.4151 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.6408 -0.0277 1.9607 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.6565 1.4690 1.6630 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.5378 2.7904 -1.0076 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.1495 2.8379 -0.2655 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.6981 3.5270 0.5992 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