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
6.9586 3.1980 0.2866 C 0 0 0 0 0 0 0 0 0 0 0 0
6.5993 1.9560 0.5265 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9829 1.1201 -0.5281 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7866 1.5766 -1.6825 O 0 0 0 0 0 0 0 0 0 0 0 0
5.6042 -0.1860 -0.2785 O 0 0 0 0 0 0 0 0 0 0 0 0
5.0037 -0.9893 -1.3185 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7228 -2.3242 -0.7186 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8575 -2.2220 0.3541 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5550 -1.8227 0.3845 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7803 -1.4512 -0.6893 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4534 -1.0553 -0.5268 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1458 -1.0174 0.7101 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6116 -1.3865 1.7997 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9186 -1.7758 1.6388 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5232 -0.6044 0.8622 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0436 -0.5782 1.9920 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.2591 -0.2404 -0.2413 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.5878 0.1671 -0.1709 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6276 -0.7103 -0.2662 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.9189 -0.2014 -0.1836 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.1738 1.1456 -0.0107 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.0963 2.0210 0.0837 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8200 1.5140 0.0016 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.4298 1.6924 0.0761 O 0 0 0 0 0 0 0 0 0 0 0 0
-8.5925 0.9238 -0.0037 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8094 3.6292 -0.6860 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4041 3.7973 1.0543 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7573 1.5448 1.5051 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7201 -1.0337 -2.1687 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1482 -0.3999 -1.6520 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3077 -3.0060 -1.5205 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6620 -2.8525 -0.4056 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1826 -1.4808 -1.6892 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1345 -0.7677 -1.3820 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1473 -1.3610 2.7865 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5274 -2.0710 2.5013 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.4209 -1.7497 -0.3998 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.7540 -0.8814 -0.2570 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.2407 3.0773 0.2185 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9843 2.2263 0.0791 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.4252 1.5961 -0.3540 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.8518 0.5449 1.0066 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.4707 0.1119 -0.7340 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