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
8.1938 -1.4867 -1.3009 C 0 0 0 0 0 0 0 0 0 0 0 0
7.3998 -0.5297 -1.6584 C 0 0 0 0 0 0 0 0 0 0 0 0
6.5556 0.1416 -0.6491 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7830 1.0725 -0.9956 O 0 0 0 0 0 0 0 0 0 0 0 0
6.5878 -0.2230 0.6731 O 0 0 0 0 0 0 0 0 0 0 0 0
5.8381 0.3354 1.6858 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3600 0.2124 1.6096 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7409 0.7752 0.5020 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3791 0.7497 0.2778 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8652 1.3367 -0.8514 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5101 1.2990 -1.0528 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3104 0.6799 -0.1304 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1768 0.0840 1.0093 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5583 0.1329 1.1962 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7382 0.6634 -0.3831 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2224 1.2025 -1.4228 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5668 0.0423 0.5410 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.9413 0.0043 0.3364 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.7351 1.0211 0.8269 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.0983 0.9949 0.6306 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.7246 -0.0280 -0.0517 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.9314 -1.0438 -0.5417 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5616 -1.0207 -0.3465 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.1193 -0.0201 -0.2321 O 0 0 0 0 0 0 0 0 0 0 0 0
-8.7287 -1.0710 -0.9287 C 0 0 0 0 0 0 0 0 0 0 0 0
8.8332 -2.0127 -1.9950 H 0 0 0 0 0 0 0 0 0 0 0 0
8.2518 -1.8087 -0.2629 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3189 -0.1896 -2.6687 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1519 1.4015 1.9214 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1428 -0.2048 2.6392 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1117 -0.8889 1.6906 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8960 0.6562 2.5166 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5008 1.8326 -1.5946 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1252 1.7699 -1.9533 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4411 -0.4080 1.7489 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9513 -0.3322 2.0883 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2309 1.8230 1.3636 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.7126 1.7910 1.0156 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.4181 -1.8592 -1.0840 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9416 -1.8172 -0.7309 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.5808 -0.9043 -2.0303 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.3974 -2.0712 -0.6378 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.8315 -0.9675 -0.7703 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