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
5.7858 -1.6549 2.7940 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4005 -1.0581 1.7956 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5882 -0.2959 0.8385 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3532 -0.2579 1.0286 O 0 0 0 0 0 0 0 0 0 0 0 0
6.0910 0.3604 -0.2249 O 0 0 0 0 0 0 0 0 0 0 0 0
5.5443 1.1221 -1.2265 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8385 2.3773 -0.8746 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7391 2.3812 -0.0850 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4739 1.8674 -0.2247 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0517 1.1845 -1.3441 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7571 0.6942 -1.4074 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1356 0.8655 -0.3819 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2680 1.5452 0.7437 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5423 2.0257 0.8020 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4751 0.3507 -0.4629 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8300 -0.2687 -1.4982 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.4029 0.5130 0.5700 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.6632 -0.0179 0.3960 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6740 0.7189 -0.1757 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.9519 0.1836 -0.3533 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.2103 -1.1086 0.0508 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.2081 -1.8574 0.6244 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9578 -1.2972 0.7846 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.4735 -1.6455 -0.1219 O 0 0 0 0 0 0 0 0 0 0 0 0
-7.7653 -2.9662 0.2830 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3522 -2.2239 3.5164 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7162 -1.6057 2.9347 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4715 -1.1359 1.6967 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4419 1.4649 -1.8616 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9677 0.5277 -1.9801 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6255 3.1235 -0.5309 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5320 2.8338 -1.8861 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7324 1.0339 -2.1945 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4543 0.1585 -2.3058 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4611 1.6664 1.5415 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8837 2.5699 1.6895 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.4974 1.7285 -0.4989 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.7609 0.7398 -0.7984 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.4270 -2.8616 0.9331 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1728 -1.9038 1.2413 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.9861 -3.6369 -0.1299 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.7850 -3.2436 -0.0724 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.7731 -2.9971 1.4059 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