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
8.9994 1.2454 1.9015 C 0 0 0 0 0 0 0 0 0 0 0 0
8.4333 0.3282 1.0157 O 0 0 0 0 0 0 0 0 0 0 0 0
7.0779 0.0514 0.9156 C 0 0 0 0 0 0 0 0 0 0 0 0
6.7245 -0.9060 -0.0427 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3849 -1.2093 -0.1728 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4192 -0.6171 0.5870 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8020 0.3192 1.5189 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1305 0.6627 1.6930 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0762 -0.9272 0.4501 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2996 -0.1946 -0.4571 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8654 0.7180 -1.1094 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8818 -0.4755 -0.6438 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2290 -1.4701 0.0559 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1162 -1.6895 -0.1641 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8628 -0.9538 -1.0647 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1675 0.0454 -1.7554 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1678 0.2611 -1.5351 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2095 -1.1912 -1.2688 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.8818 -0.3724 -2.2218 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.3425 -0.7534 -2.3310 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.0206 -0.6155 -1.1206 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.1589 0.5500 -0.4129 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.6422 1.5999 -0.8674 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.8864 0.5999 0.8460 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.4243 -0.4930 1.3191 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.0177 1.8652 1.5822 C 0 0 0 0 0 0 0 0 0 0 0 0
8.3592 2.0844 2.1817 H 0 0 0 0 0 0 0 0 0 0 0 0
9.3874 0.6699 2.7913 H 0 0 0 0 0 0 0 0 0 0 0 0
9.8885 1.6983 1.3730 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4660 -1.3776 -0.6439 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1264 -1.9489 -0.9151 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0576 0.8110 2.1418 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4542 1.3936 2.4168 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8019 -2.0475 0.7587 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5948 -2.4771 0.4020 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6896 0.6600 -2.4761 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6766 1.0445 -2.0879 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3566 -0.5381 -3.1839 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7846 0.7004 -1.9648 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.3751 -1.8423 -2.6079 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.7799 -0.2077 -3.1761 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.3307 -1.4145 0.7863 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.9622 -0.4730 2.2430 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.0309 2.1468 1.9807 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.7459 1.8266 2.3916 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.3283 2.6596 0.8711 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