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
8.4914 1.8398 -1.9964 C 0 0 0 0 0 0 0 0 0 0 0 0
8.4755 0.5340 -2.0060 C 0 0 0 0 0 0 0 0 0 0 0 0
7.3054 -0.2089 -1.5551 C 0 0 0 0 0 0 0 0 0 0 0 0
7.3575 -1.4857 -1.5894 O 0 0 0 0 0 0 0 0 0 0 0 0
6.1657 0.4016 -1.1017 O 0 0 0 0 0 0 0 0 0 0 0 0
5.0031 -0.2644 -0.6586 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3875 -1.0872 -1.7658 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2456 -1.7773 -1.4605 O 0 0 0 0 0 0 0 0 0 0 0 0
1.9967 -1.3017 -1.1157 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6586 0.0294 -1.0505 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3851 0.4065 -0.6911 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6042 -0.4993 -0.3834 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2481 -1.8251 -0.4550 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9957 -2.2255 -0.8049 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9170 -0.0352 -0.0158 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1676 1.1964 0.0274 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.9707 -0.8844 0.3081 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.2138 -0.3688 0.6538 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.1957 -0.1222 -0.2891 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.4245 0.3900 0.0718 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.7290 0.6787 1.3865 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.7611 0.4388 2.3397 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5501 -0.0681 1.9683 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.9649 1.1956 1.7621 O 0 0 0 0 0 0 0 0 0 0 0 0
-8.2254 1.4741 3.1231 C 0 0 0 0 0 0 0 0 0 0 0 0
9.3555 2.3750 -2.3297 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6323 2.3785 -1.6521 H 0 0 0 0 0 0 0 0 0 0 0 0
9.3346 -0.0043 -2.3500 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3331 0.4937 -0.2341 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2772 -0.9790 0.1841 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2887 -0.4494 -2.6961 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1699 -1.8638 -2.0393 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4070 0.7967 -1.3120 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2010 1.4876 -0.6631 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0286 -2.5387 -0.2127 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2828 -3.2869 -0.8627 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.0057 -0.3298 -1.3154 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.1930 0.5836 -0.6611 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.9529 0.6485 3.3777 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7799 -0.2622 2.7033 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.0301 0.5093 3.6750 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.5300 2.2460 3.5207 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.2575 1.7641 3.3160 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