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
-8.3924 -1.7641 -0.2600 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.4833 -0.4806 0.0155 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.2896 0.3214 0.3569 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.4409 1.5353 0.6086 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.0827 -0.3100 0.3789 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.8937 0.3543 0.6842 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6205 1.4251 -0.3221 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4590 2.1029 -0.0706 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1672 1.6625 -0.0851 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7311 0.4025 -0.3990 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3731 0.0634 -0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5590 1.0038 -0.0299 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1007 2.2566 0.2789 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2014 2.6168 0.2652 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9812 0.7359 0.0207 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7695 1.6545 0.3460 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5446 -0.4973 -0.2733 O 0 0 0 0 0 0 0 0 0 0 0 0
3.8953 -0.7603 -0.2275 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6995 -0.5836 -1.3300 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0585 -0.8431 -1.3011 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6249 -1.2940 -0.1276 C 0 0 0 0 0 0 0 0 0 0 0 0
5.8451 -1.4807 0.9933 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4735 -1.2093 0.9322 C 0 0 0 0 0 0 0 0 0 0 0 0
7.9716 -1.5650 -0.0520 O 0 0 0 0 0 0 0 0 0 0 0 0
8.8136 -1.3886 -1.1766 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.4432 -2.2618 -0.2430 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.2776 -2.3250 -0.5057 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.4383 0.0048 -0.0051 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0540 -0.3248 0.8437 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.0492 0.8226 1.7226 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.5061 2.1163 -0.4418 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5548 0.9487 -1.3452 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4326 -0.3535 -0.6968 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0395 -0.9364 -0.6233 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8384 3.0197 0.5560 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4950 3.6357 0.5233 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2923 -0.2332 -2.2625 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7195 -0.7158 -2.1468 H 0 0 0 0 0 0 0 0 0 0 0 0
6.2381 -1.8289 1.9272 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8419 -1.3475 1.7961 H 0 0 0 0 0 0 0 0 0 0 0 0
8.7554 -0.3714 -1.5676 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5631 -2.1265 -1.9878 H 0 0 0 0 0 0 0 0 0 0 0 0
9.8394 -1.6815 -0.8422 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