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
8.9906 -0.7040 -1.5731 C 0 0 0 0 0 0 0 0 0 0 0 0
9.2622 -0.5565 -0.2666 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1466 -0.3454 0.6405 C 0 0 0 0 0 0 0 0 0 0 0 0
8.3547 -0.2047 1.8541 O 0 0 0 0 0 0 0 0 0 0 0 0
6.8271 -0.2919 0.2060 O 0 0 0 0 0 0 0 0 0 0 0 0
5.7727 -0.0831 1.1339 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4720 -0.0752 0.3616 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3736 0.1294 1.2291 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0739 0.1823 0.8036 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0864 0.3888 1.7564 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2404 0.4494 1.3727 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6305 0.3112 0.0613 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3419 0.1062 -0.8898 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6835 0.0442 -0.5069 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0305 0.3757 -0.3396 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3974 0.2507 -1.5340 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.0434 0.5819 0.5959 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.3848 0.6470 0.2375 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.0194 1.8191 -0.1056 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.3549 1.8162 -0.4521 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.1168 0.6699 -0.4758 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.4842 -0.5077 -0.1323 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.1359 -0.5088 0.2181 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.4647 0.6816 -0.8277 O 0 0 0 0 0 0 0 0 0 0 0 0
-9.2518 -0.4829 -0.8554 C 0 0 0 0 0 0 0 0 0 0 0 0
9.7786 -0.8638 -2.2959 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9779 -0.6671 -1.9390 H 0 0 0 0 0 0 0 0 0 0 0 0
10.2613 -0.5926 0.0962 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7467 -0.9390 1.8270 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9251 0.8880 1.6576 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4380 0.7066 -0.4108 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4045 -1.0832 -0.1395 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3634 0.5027 2.8081 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9837 0.6112 2.1387 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1421 -0.0147 -1.9455 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4726 -0.1179 -1.2462 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.4547 2.7504 -0.1005 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.8752 2.7376 -0.7274 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.0501 -1.4455 -0.1366 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.6780 -1.4443 0.4793 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.4445 -0.8788 0.1739 H 0 0 0 0 0 0 0 0 0 0 0 0
-10.2186 -0.3438 -1.3493 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.6360 -1.2570 -1.4020 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