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
9.4465 -0.5144 -0.3091 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5525 -0.0341 0.6591 O 0 0 0 0 0 0 0 0 0 0 0 0
7.1870 0.1232 0.4143 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6734 -0.2001 -0.8216 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3169 -0.0422 -1.0600 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4716 0.4331 -0.0812 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9822 0.7580 1.1579 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3368 0.5944 1.3782 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0981 0.5887 -0.3353 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2580 -0.4736 -0.0742 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7502 -1.5330 0.3780 O 0 0 0 0 0 0 0 0 0 0 0 0
0.8303 -0.3776 -0.3147 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0057 -1.4514 -0.0471 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3674 -1.3548 -0.2799 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9354 -0.2002 -0.7774 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0936 0.8611 -1.0380 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2577 0.7690 -0.8100 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3032 -0.1265 -1.0013 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.8426 1.0589 -1.5058 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.3176 1.0084 -1.7003 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.0786 0.7682 -0.5586 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.0687 -0.3592 0.2103 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.3229 -1.3237 -0.0905 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.9271 -0.4729 1.4052 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.9247 -1.5580 2.1545 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.8127 0.6499 1.7778 C 0 0 0 0 0 0 0 0 0 0 0 0
9.2458 -0.0307 -1.2884 H 0 0 0 0 0 0 0 0 0 0 0 0
10.4860 -0.2631 -0.0063 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2967 -1.6002 -0.4323 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3110 -0.5811 -1.6271 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8770 -0.2843 -2.0144 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3112 1.1313 1.9231 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7579 0.8435 2.3438 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3926 -2.3909 0.3469 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0405 -2.1814 -0.0795 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5512 1.7725 -1.4321 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8859 1.6090 -1.0217 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6133 1.9426 -0.8651 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4047 1.3310 -2.5083 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.6107 2.0116 -2.1235 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.5966 0.2730 -2.5214 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.5528 -1.6381 3.0266 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.2886 -2.3973 1.9096 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.7439 0.7597 2.8843 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.8536 0.4816 1.4541 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.4806 1.6200 1.3499 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