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
-9.3059 -0.5678 0.8729 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.2237 -0.9206 1.6746 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.9064 -0.6133 1.3656 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.8940 -1.0023 2.2186 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5703 -0.7043 1.9269 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2094 -0.0201 0.7957 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.2246 0.3668 -0.0542 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.5572 0.0759 0.2236 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9094 0.3074 0.4484 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1261 -0.5601 -0.3294 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7023 -1.6339 -0.6714 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7723 -0.2334 -0.6988 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1854 0.9350 -0.3105 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1274 1.2575 -0.6658 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8405 0.3748 -1.4216 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2625 -0.8438 -1.8414 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0297 -1.1015 -1.4608 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1295 0.6396 -1.7882 O 0 0 0 0 0 0 0 0 0 0 0 0
3.8537 1.7490 -1.4094 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1506 1.7436 0.0627 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9204 0.5661 0.3862 O 0 0 0 0 0 0 0 0 0 0 0 0
6.1525 0.3144 -0.1477 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6734 1.1284 -0.9629 O 0 0 0 0 0 0 0 0 0 0 0 0
6.8618 -0.8926 0.2254 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3224 -1.7352 1.0693 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1923 -1.1611 -0.3531 C 0 0 0 0 0 0 0 0 0 0 0 0
-9.1570 -0.8774 -0.2007 H 0 0 0 0 0 0 0 0 0 0 0 0
-10.2285 -1.0111 1.2928 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.4180 0.5322 0.8447 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.1095 -1.5527 3.1415 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7991 -1.0213 2.6128 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.9937 0.9112 -0.9640 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.3597 0.3756 -0.4375 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7273 1.6453 0.2865 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5377 2.1966 -0.3732 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8738 -1.5033 -2.4392 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4364 -2.0599 -1.8101 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1978 2.6604 -1.5683 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7775 1.8962 -2.0153 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3311 1.7382 0.7517 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8104 2.6010 0.3536 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8483 -2.6270 1.3439 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3491 -1.5931 1.5273 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9124 -1.3852 0.4731 H 0 0 0 0 0 0 0 0 0 0 0 0
8.1899 -2.0768 -0.9987 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5308 -0.3282 -0.9757 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