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
9.2195 -0.1392 2.1615 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6031 -0.9375 1.1674 O 0 0 0 0 0 0 0 0 0 0 0 0
7.3281 -0.5655 0.7631 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6430 -1.2818 -0.2023 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3767 -0.9163 -0.6071 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7408 0.1798 -0.0653 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4135 0.9001 0.8964 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6595 0.5273 1.2840 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4678 0.4983 -0.5122 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3111 0.0197 0.0419 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4072 -0.7611 1.0218 O 0 0 0 0 0 0 0 0 0 0 0 0
0.9788 0.3589 -0.4333 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1456 -0.1545 0.1655 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4372 0.1657 -0.2844 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6319 1.0074 -1.3464 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4771 1.5256 -1.9490 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7758 1.2042 -1.4981 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8177 1.3814 -1.8684 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.0825 0.9811 -1.4859 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3980 -0.4791 -1.7036 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.7070 -0.7447 -1.2686 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.1174 -0.6030 0.0240 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.3495 -0.2268 0.9299 O 0 0 0 0 0 0 0 0 0 0 0 0
-7.5105 -0.9019 0.3686 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.3567 -1.2999 -0.5437 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.9971 -0.7607 1.7622 C 0 0 0 0 0 0 0 0 0 0 0 0
10.2225 -0.5312 2.4417 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2137 0.9147 1.8834 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5954 -0.2268 3.0970 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1697 -2.1488 -0.6177 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8931 -1.5352 -1.3810 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8801 1.7665 1.3076 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1848 1.1025 2.0454 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0125 -0.8268 1.0114 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2834 -0.2585 0.2574 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5992 2.1897 -2.7840 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6867 1.6038 -1.9620 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2600 1.2255 -0.4115 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.8189 1.5487 -2.1205 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6532 -1.1391 -1.2523 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.4279 -0.6831 -2.8311 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.3892 -1.5294 -0.3290 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.0676 -1.4272 -1.5960 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.5047 0.1065 2.2701 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.6490 -1.6601 2.3263 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.0772 -0.6003 1.8267 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