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
8.0102 -0.5209 -2.2356 C 0 0 0 0 0 0 0 0 0 0 0 0
6.9779 0.2396 -1.9218 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6276 0.4334 -0.5255 C 0 0 0 0 0 0 0 0 0 0 0 0
7.3084 -0.1230 0.3691 O 0 0 0 0 0 0 0 0 0 0 0 0
5.5618 1.2176 -0.1818 O 0 0 0 0 0 0 0 0 0 0 0 0
5.1572 1.4538 1.1550 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7749 0.1955 1.8837 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7413 -0.5029 1.3265 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4300 -0.2353 1.1116 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6735 -1.2308 0.4668 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3370 -1.0342 0.2159 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3153 0.1248 0.5763 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4314 1.0874 1.2040 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7844 0.9123 1.4694 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7297 0.3018 0.2964 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2880 1.3878 0.6476 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5143 -0.6306 -0.3270 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.8438 -0.4052 -0.5633 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2628 0.1843 -1.7277 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.6245 0.4164 -1.9724 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.5500 0.0314 -0.9977 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.1376 -0.5573 0.1662 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.7894 -0.7661 0.3644 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.8833 0.2505 -1.2199 O 0 0 0 0 0 0 0 0 0 0 0 0
-8.8391 -0.1266 -0.2565 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5789 -0.9869 -1.4620 H 0 0 0 0 0 0 0 0 0 0 0 0
8.2984 -0.6868 -3.2538 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3789 0.7286 -2.6965 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0051 1.9145 1.7207 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3625 2.1877 1.1598 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5451 0.5357 2.9441 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7032 -0.4170 2.0177 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1391 -2.1469 0.1692 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2318 -1.8213 -0.2865 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0586 2.0153 1.5008 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3060 1.6942 1.9764 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5808 0.4933 -2.4992 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.9880 0.8783 -2.8784 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.8510 -0.8483 0.9054 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.4770 -1.2318 1.2874 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.5233 0.3055 0.7214 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.8590 0.1960 -0.5160 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.7857 -1.2379 -0.1339 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