Monomers
4-[2-(Acryloyloxy)ethoxy]benzoic acid 4-methoxyphenyl ester
Identifiers
IUPAC name
(4-methoxyphenyl) 4-(2-prop-2-enoyloxyethoxy)benzoate
InchI
InChI=1S/C19H18O6/c1-3-18(20)24-13-12-23-16-6-4-14(5-7-16)19(21)25-17-10-8-15(22-2)9-11-17/h3-11H,1,12-13H2,2H3
InchI Key
FJYJQYRUKLDXEE-UHFFFAOYSA-N
SMILES
C=CC(=O)OCCOc1ccc(cc1)C(=O)Oc1ccc(cc1)OC
Canonical SMILES
COC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)OCCOC(=O)C=C
Isomeric SMILES
COC1=CC=C(C=C1)OC(=O)C2=CC=C(C=C2)OCCOC(=O)C=C
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C19H18O6
Heavy Atom Count
25
Molecular Weight
342.347
Exact Molecular Weight
342.1103
Valence Electrons
130
Radical Electrons
0
tPSA
71.06
MolLogP
3.0224
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
43 44 0 0 0 0 0 0 0 0999 V2000
7.4268 -2.7945 -0.6431 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2828 -2.5578 -0.0376 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4184 -1.4509 -0.4558 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3631 -1.3031 0.1693 O 0 0 0 0 0 0 0 0 0 0 0 0
5.7073 -0.6082 -1.4603 O 0 0 0 0 0 0 0 0 0 0 0 0
5.0525 0.4615 -1.9879 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7829 1.6611 -1.1672 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0108 1.5820 -0.0432 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7001 1.2940 0.1846 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1931 1.2735 1.4992 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8675 0.9835 1.7205 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0129 0.7051 0.6989 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4781 0.7257 -0.5691 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8224 1.0188 -0.8105 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4022 0.4063 1.0038 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8388 0.3910 2.1731 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.2999 0.1241 -0.0154 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.6252 -0.1687 0.1696 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0271 -1.4676 0.3471 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.3806 -1.7789 0.5374 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.3171 -0.7750 0.5466 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.9229 0.5341 0.3690 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5643 0.8316 0.1796 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.6744 -1.1028 0.7389 O 0 0 0 0 0 0 0 0 0 0 0 0
-8.6047 -0.0375 0.7413 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7130 -2.1497 -1.4589 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0789 -3.5900 -0.3649 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9802 -3.1813 0.7699 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1361 0.1986 -2.5757 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7411 0.8426 -2.8366 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2163 2.3789 -1.8717 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7272 2.2721 -0.9962 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9003 1.4943 2.2819 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4988 0.9737 2.7471 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1825 0.5112 -1.4120 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1392 1.0298 -1.8486 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3464 -2.2974 0.3504 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.6716 -2.7916 0.6731 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.6626 1.3278 0.3763 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2796 1.8656 0.0425 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.4692 0.5708 -0.1928 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.6396 -0.3776 0.8359 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.3154 0.6272 1.5914 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 2 3
2 3 1 0
3 4 2 0
3 5 1 0
5 6 1 0
6 7 1 0
7 8 1 0
8 9 1 0
9 10 2 0
10 11 1 0
11 12 2 0
12 13 1 0
13 14 2 0
12 15 1 0
15 16 2 0
15 17 1 0
17 18 1 0
18 19 2 0
19 20 1 0
20 21 2 0
21 22 1 0
22 23 2 0
21 24 1 0
24 25 1 0
14 9 1 0
23 18 1 0
1 26 1 0
1 27 1 0
2 28 1 0
6 29 1 0
6 30 1 0
7 31 1 0
7 32 1 0
10 33 1 0
11 34 1 0
13 35 1 0
14 36 1 0
19 37 1 0
20 38 1 0
22 39 1 0
23 40 1 0
25 41 1 0
25 42 1 0
25 43 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers