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
8.4339 3.6934 0.5490 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1678 2.4293 -0.0603 O 0 0 0 0 0 0 0 0 0 0 0 0
6.8644 2.0270 -0.2627 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7948 2.8111 0.1067 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4953 2.3632 -0.1177 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2485 1.1478 -0.7034 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3246 0.3595 -1.0748 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6326 0.8051 -0.8516 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9425 0.6858 -0.9346 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3429 -0.0550 0.0672 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9838 -0.2769 1.1209 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9862 -0.5570 -0.1267 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2746 -0.3216 -1.2733 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0144 -0.8222 -1.4077 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6068 -1.5595 -0.4066 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9090 -1.8027 0.7437 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3758 -1.3057 0.8819 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8876 -2.0463 -0.5624 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.5440 -2.8039 0.4232 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.9311 -3.1576 -0.1096 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.6822 -2.0016 -0.3896 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.0096 -1.0485 0.5522 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.6366 -1.1834 1.7317 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.7895 0.1061 0.1526 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.2016 0.2809 -1.0903 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.1200 1.1157 1.2167 C 0 0 0 0 0 0 0 0 0 0 0 0
9.4935 3.8045 0.8033 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0915 4.4781 -0.1428 H 0 0 0 0 0 0 0 0 0 0 0 0
7.8126 3.7787 1.4807 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9880 3.7715 0.5695 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6579 2.9760 0.1711 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1451 -0.5942 -1.5344 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4528 0.1653 -1.1533 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7462 0.2540 -2.0466 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5440 -0.6151 -2.3281 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2979 -2.3706 1.5767 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9580 -1.4863 1.7950 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5787 -2.3091 1.3941 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0376 -3.7965 0.5837 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.4674 -3.7733 0.6163 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.7782 -3.7097 -1.0521 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.9573 -0.4479 -1.8352 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.7760 1.1482 -1.3450 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.1491 2.1019 0.6779 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.2369 1.1679 1.8793 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.0576 0.8660 1.7158 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