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
7.9600 -2.9415 1.0373 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7624 -1.8727 0.2947 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4942 -1.1416 0.4093 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5965 -1.5109 1.1965 O 0 0 0 0 0 0 0 0 0 0 0 0
6.2883 -0.0246 -0.3672 O 0 0 0 0 0 0 0 0 0 0 0 0
5.0971 0.7297 -0.3101 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8048 1.3331 1.0213 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6184 2.0443 0.9950 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3472 1.5680 0.8166 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0181 0.2472 0.6691 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6930 -0.1800 0.4826 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3321 0.7151 0.4417 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0165 2.0453 0.5898 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2706 2.4813 0.7722 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6974 0.2484 0.2473 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9354 -0.9790 0.1166 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.7833 1.1120 0.1969 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.0774 0.5959 0.0064 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.8653 0.2357 1.0804 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.1327 -0.2689 0.8719 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.6500 -0.4285 -0.4147 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.8646 -0.0696 -1.4840 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6191 0.4253 -1.2510 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.9291 -0.9384 -0.6089 O 0 0 0 0 0 0 0 0 0 0 0 0
-8.4157 -1.0845 -1.9254 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2097 -3.2830 1.7215 H 0 0 0 0 0 0 0 0 0 0 0 0
8.8854 -3.4752 0.9539 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5148 -1.5202 -0.3994 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2236 0.2703 -0.7519 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3397 1.6381 -0.9827 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6451 2.0344 1.3119 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7476 0.5387 1.8218 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7769 -0.5215 0.7213 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4797 -1.2368 0.3692 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8691 2.7375 0.5520 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4785 3.5266 0.8840 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5157 0.3378 2.0996 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.7798 -0.5628 1.7060 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.2844 -0.2004 -2.4938 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9995 0.7082 -2.0906 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.6815 -1.6868 -2.5139 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.4095 -0.0742 -2.3957 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.3938 -1.5717 -1.9535 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