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
7.9298 1.0839 -2.4492 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0785 0.1558 -2.6273 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3857 -0.3399 -1.3854 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5366 -1.2464 -1.5292 O 0 0 0 0 0 0 0 0 0 0 0 0
6.6688 0.1701 -0.1579 O 0 0 0 0 0 0 0 0 0 0 0 0
6.1134 -0.1957 1.0456 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6557 0.1128 1.2065 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9091 -0.5435 0.2259 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5305 -0.4216 0.2056 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7830 -1.0662 -0.7589 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4057 -0.9888 -0.8310 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2972 -0.2328 0.0983 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4291 0.4156 1.0622 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8164 0.3347 1.1316 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7588 -0.1808 0.0217 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3747 -0.8294 -0.8887 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5521 0.5439 0.8934 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.9611 0.5191 0.7348 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6074 1.4585 -0.0485 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.9780 1.3954 -0.1746 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.7292 0.4017 0.4735 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.0892 -0.5324 1.2513 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.7226 -0.4359 1.3517 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.0978 0.3848 0.3125 O 0 0 0 0 0 0 0 0 0 0 0 0
-8.9488 -0.5597 0.9031 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5961 1.8138 -2.2907 H 0 0 0 0 0 0 0 0 0 0 0 0
8.2470 1.1553 -3.7688 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7769 -0.3429 -3.5645 H 0 0 0 0 0 0 0 0 0 0 0 0
6.2537 -1.3236 1.2290 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7149 0.2435 1.8991 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4970 1.2268 1.1356 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3445 -0.1981 2.2437 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3330 -1.6583 -1.4884 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1588 -1.5094 -1.6013 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0889 1.0096 1.7968 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3780 0.8459 1.8906 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0447 2.2124 -0.5494 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.5211 2.1110 -0.7784 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.6487 -1.3319 1.7688 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2033 -1.1755 1.9774 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.9413 -0.0755 1.0516 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.0514 -1.5006 0.2994 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.6081 -0.9055 1.9123 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