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
9.3121 -0.8240 0.3358 C 0 0 0 0 0 0 0 0 0 0 0 0
8.3733 -0.9857 1.3597 O 0 0 0 0 0 0 0 0 0 0 0 0
7.0575 -0.6345 1.1343 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6392 -0.1286 -0.0702 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3122 0.2221 -0.2875 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3961 0.0570 0.7330 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8021 -0.4498 1.9473 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1437 -0.7959 2.1426 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0587 0.4208 0.4842 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1825 -0.5362 -0.0285 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6080 -1.6742 -0.2484 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7967 -0.1557 -0.2852 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3316 1.1186 -0.0359 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9872 1.4318 -0.2946 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8872 0.5145 -0.8020 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4170 -0.7595 -1.0498 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0950 -1.0779 -0.7918 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2153 0.8423 -1.0589 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.7806 2.0818 -0.8464 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.2306 2.1068 -1.2243 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.9702 1.2060 -0.4910 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.9223 -0.1569 -0.4515 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.1103 -0.7770 -1.1713 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.8092 -0.8975 0.4221 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.8035 -2.2219 0.4986 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.7703 -0.1553 1.2734 C 0 0 0 0 0 0 0 0 0 0 0 0
9.2370 0.1395 -0.2004 H 0 0 0 0 0 0 0 0 0 0 0 0
10.3554 -0.8694 0.7416 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2408 -1.6532 -0.4065 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3232 0.0203 -0.9056 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9843 0.6210 -1.2384 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0601 -0.5668 2.7255 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4740 -1.1939 3.0895 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0187 1.8737 0.3675 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3608 2.4295 -0.1020 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1060 -1.5151 -1.4539 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2704 -2.0831 -0.9889 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6898 2.4485 0.2032 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2904 2.8944 -1.4678 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.2810 1.8896 -2.3404 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.6824 3.1264 -1.0547 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.0784 -2.7315 -0.1468 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.4665 -2.7591 1.1507 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.2093 0.6408 1.7938 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.5023 0.3509 0.6120 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.3117 -0.8337 1.9661 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