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
-9.0785 -0.6275 0.7739 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.0377 -1.1156 1.5738 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.7061 -0.7656 1.2803 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.6606 -1.2229 2.0389 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3675 -0.8592 1.7219 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1033 -0.0381 0.6482 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.1596 0.4066 -0.0949 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.4489 0.0581 0.2023 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7845 0.3348 0.3221 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.9904 -0.3817 -0.5293 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4540 -1.4260 -1.0505 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.6249 -0.0149 -0.8803 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0279 1.1074 -0.3641 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2759 1.4993 -0.6706 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0180 0.7381 -1.5295 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4305 -0.4200 -2.0753 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1461 -0.7617 -1.7430 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3047 1.0627 -1.8709 O 0 0 0 0 0 0 0 0 0 0 0 0
4.1607 2.0570 -1.5255 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6815 2.1478 -0.1284 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4338 1.1037 0.3600 O 0 0 0 0 0 0 0 0 0 0 0 0
5.1505 -0.1856 0.5893 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0102 -0.6261 0.3529 O 0 0 0 0 0 0 0 0 0 0 0 0
6.1978 -1.0828 1.1242 C 0 0 0 0 0 0 0 0 0 0 0 0
5.8626 -2.3421 1.3305 C 0 0 0 0 0 0 0 0 0 0 0 0
7.5594 -0.5802 1.4122 C 0 0 0 0 0 0 0 0 0 0 0 0
-9.0894 0.4841 0.7750 H 0 0 0 0 0 0 0 0 0 0 0 0
-10.0505 -1.0704 0.9821 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.8244 -0.9232 -0.2866 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.8980 -1.8689 2.8797 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5509 -1.2328 2.3365 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.9755 1.0488 -0.9376 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.2990 0.4239 -0.4063 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5655 1.7441 0.3182 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6726 2.4257 -0.2246 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0502 -1.0004 -2.7549 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3096 -1.6554 -2.1631 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6318 3.0732 -1.6804 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0320 2.1491 -2.2505 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7937 2.3641 0.5507 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2895 3.1126 -0.0947 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6185 -3.0206 1.7242 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8703 -2.7167 1.1227 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6488 -0.0644 2.3709 H 0 0 0 0 0 0 0 0 0 0 0 0
8.2394 -1.4516 1.3973 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9284 0.1133 0.6182 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