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
-8.3114 2.5557 -1.3179 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.8456 1.5641 -0.6488 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.0110 0.5162 -0.0216 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.5323 -0.4303 0.6176 O 0 0 0 0 0 0 0 0 0 0 0 0
-6.6301 0.5398 -0.1157 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.8258 -0.4801 0.4952 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3596 -0.1535 0.2011 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5141 -1.1185 0.7742 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.1450 -1.0553 0.6553 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3786 -2.0391 1.2450 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0165 -2.0069 1.1445 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6535 -1.0022 0.4611 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0910 -0.0116 -0.1343 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4830 -0.0574 -0.0252 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0993 -0.9433 0.3404 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7683 -1.8563 0.8901 O 0 0 0 0 0 0 0 0 0 0 0 0
2.7539 0.0678 -0.3481 O 0 0 0 0 0 0 0 0 0 0 0 0
4.1351 0.0597 -0.4219 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7532 -0.5920 -1.4641 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1392 -0.5957 -1.5312 C 0 0 0 0 0 0 0 0 0 0 0 0
6.9036 0.0361 -0.5813 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2430 0.6794 0.4496 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8732 0.6976 0.5386 C 0 0 0 0 0 0 0 0 0 0 0 0
8.2725 0.0145 -0.6756 O 0 0 0 0 0 0 0 0 0 0 0 0
9.0481 0.6741 0.3170 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.9306 3.3005 -1.7622 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.2468 2.6194 -1.4197 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.9162 1.5048 -0.5495 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.0132 -0.5268 1.5755 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.0285 -1.4661 0.0478 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1970 -0.0223 -0.8874 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1254 0.8312 0.6638 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8319 -2.8518 1.7943 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6200 -2.7880 1.6130 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3900 0.7920 -0.6793 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0395 0.7210 -0.4947 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2004 -1.1007 -2.2316 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6044 -1.1101 -2.3529 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8368 1.1785 1.2005 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3801 1.2011 1.3445 H 0 0 0 0 0 0 0 0 0 0 0 0
8.7249 0.4026 1.3299 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9069 1.7738 0.2109 H 0 0 0 0 0 0 0 0 0 0 0 0
10.1339 0.4783 0.1618 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