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
8.8034 -1.4001 2.5960 C 0 0 0 0 0 0 0 0 0 0 0 0
7.5548 -1.3699 3.2344 O 0 0 0 0 0 0 0 0 0 0 0 0
6.3677 -1.2601 2.5381 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3625 -1.1753 1.1743 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1618 -1.0646 0.4766 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9632 -1.0393 1.1545 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9756 -1.1252 2.5286 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1718 -1.2354 3.2224 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7494 -0.9290 0.4741 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1578 0.2891 0.1850 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7653 1.3195 0.5652 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8927 0.4073 -0.5239 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3581 1.6500 -0.7779 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8566 1.8104 -1.4567 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5682 0.7262 -1.8982 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0052 -0.5411 -1.6298 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1814 -0.6904 -0.9670 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7521 0.8104 -2.5566 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.5473 1.8634 -2.9196 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1089 2.5741 -1.7406 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.9080 1.7483 -0.9176 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.0524 1.0923 -1.3116 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.4109 1.2492 -2.5146 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.8391 0.2529 -0.4258 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.9200 -0.3407 -0.8760 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.4531 0.0449 0.9876 C 0 0 0 0 0 0 0 0 0 0 0 0
8.8877 -0.6138 1.8089 H 0 0 0 0 0 0 0 0 0 0 0 0
9.6402 -1.2522 3.3229 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9558 -2.4041 2.1655 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3179 -1.1965 0.6493 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1784 -0.9979 -0.6128 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0376 -1.1049 3.0495 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0935 -1.2980 4.3012 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9108 2.5154 -0.4332 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1706 2.8257 -1.6241 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5274 -1.4238 -1.9578 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6099 -1.6635 -0.7630 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3567 1.4532 -3.5916 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9316 2.5405 -3.5693 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3206 2.9715 -1.1034 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.7099 3.4344 -2.1444 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.5291 -0.9770 -0.2306 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.1982 -0.1839 -1.9143 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.0467 0.9602 1.4631 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.6137 -0.7054 0.9889 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.2709 -0.3771 1.5741 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