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
-8.2891 1.0278 -1.0491 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.3132 1.6224 -0.4046 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.4025 0.8501 0.4561 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.4673 1.3975 1.0781 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.5897 -0.5009 0.5742 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.8672 -1.4238 1.3097 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4393 -1.6213 0.9441 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7089 -0.4312 1.0781 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.3619 -0.4342 0.7787 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7327 -1.5832 0.3536 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3771 -1.6027 0.0483 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3487 -0.4400 0.1764 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2768 0.7128 0.6016 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6379 0.7290 0.9074 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7811 -0.4318 -0.1391 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3431 -1.4882 -0.5263 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5533 0.7087 -0.0267 O 0 0 0 0 0 0 0 0 0 0 0 0
3.9240 0.6516 -0.3447 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2589 0.9189 -1.6576 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5911 0.8724 -2.0061 C 0 0 0 0 0 0 0 0 0 0 0 0
6.5933 0.5681 -1.0857 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2033 0.3104 0.2075 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8790 0.3456 0.6026 C 0 0 0 0 0 0 0 0 0 0 0 0
7.9119 0.5411 -1.5143 O 0 0 0 0 0 0 0 0 0 0 0 0
8.9087 0.2293 -0.5588 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.9506 1.5911 -1.6747 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.4236 -0.0322 -0.9469 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.1973 2.6962 -0.5241 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.4199 -2.3955 1.3319 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.9266 -1.0806 2.3906 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9705 -2.4510 1.5501 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3209 -1.9742 -0.1132 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3381 -2.4846 0.2638 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1110 -2.5027 -0.2836 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3128 1.6121 0.6945 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0577 1.6715 1.2347 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4817 1.1603 -2.3950 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8928 1.0762 -3.0260 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9529 0.0714 0.9460 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5490 0.1477 1.6085 H 0 0 0 0 0 0 0 0 0 0 0 0
8.7658 0.8110 0.3724 H 0 0 0 0 0 0 0 0 0 0 0 0
8.7745 -0.8525 -0.2706 H 0 0 0 0 0 0 0 0 0 0 0 0
9.9317 0.3705 -0.9619 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