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
9.2273 0.9421 -1.6935 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5971 -0.3040 -1.3980 O 0 0 0 0 0 0 0 0 0 0 0 0
7.3161 -0.2879 -0.8458 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6813 -1.4767 -0.5495 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4144 -1.5162 -0.0023 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7284 -0.3512 0.2715 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3598 0.8398 -0.0234 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6338 0.8805 -0.5736 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4528 -0.3353 0.8214 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2958 -0.3471 0.0448 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4700 -0.3734 -1.2006 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9638 -0.3304 0.6261 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7347 -0.3016 1.9815 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5319 -0.2857 2.5069 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6827 -0.2977 1.6901 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4438 -0.3277 0.3369 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1423 -0.3432 -0.1881 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9195 -0.2841 2.2795 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.1622 -0.2567 1.7108 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4225 1.0082 0.9593 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.6954 1.0177 0.3778 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.1007 0.1098 -0.5705 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.3328 -0.8006 -0.9827 O 0 0 0 0 0 0 0 0 0 0 0 0
-7.4564 0.2026 -1.1146 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.2639 1.1361 -0.7012 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.9267 -0.7610 -2.1396 C 0 0 0 0 0 0 0 0 0 0 0 0
9.4837 1.3925 -0.7081 H 0 0 0 0 0 0 0 0 0 0 0 0
10.1190 0.7958 -2.3279 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5238 1.6066 -2.2598 H 0 0 0 0 0 0 0 0 0 0 0 0
7.2103 -2.3989 -0.7602 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9216 -2.4546 0.2280 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8200 1.7594 0.1920 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1168 1.8271 -0.7998 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6087 -0.2915 2.6479 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7233 -0.2628 3.5813 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2771 -0.3652 -0.3602 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0006 -0.3660 -1.2675 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2775 -1.1224 1.0161 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.9147 -0.4231 2.5233 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6175 1.2941 0.3020 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.4419 1.8220 1.7696 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.2738 1.2818 -1.0423 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.9330 1.8603 0.0588 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.4455 -1.7709 -1.9880 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.0165 -0.9554 -2.0772 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.6772 -0.3853 -3.1556 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