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
9.4746 -0.6073 -0.0439 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6444 -0.2890 0.9269 C 0 0 0 0 0 0 0 0 0 0 0 0
7.3415 0.2998 0.6104 C 0 0 0 0 0 0 0 0 0 0 0 0
6.5181 0.6190 1.4994 O 0 0 0 0 0 0 0 0 0 0 0 0
6.9753 0.5247 -0.7027 O 0 0 0 0 0 0 0 0 0 0 0 0
5.7473 1.0795 -1.0229 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5356 0.3306 -0.5976 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4004 1.0888 -1.0347 O 0 0 0 0 0 0 0 0 0 0 0 0
2.1065 0.6653 -0.7959 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0710 1.4531 -1.2498 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2619 1.0903 -1.0459 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5817 -0.0723 -0.3813 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4591 -0.8560 0.0702 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7867 -0.4967 -0.1318 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9819 -0.4499 -0.1692 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2916 -1.5060 0.4344 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.9991 0.3590 -0.6351 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.3295 0.0320 -0.4517 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.0142 -0.7216 -1.3779 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.3579 -1.0527 -1.1942 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.9932 -0.5981 -0.0417 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.3285 0.1566 0.8978 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.0117 0.4544 0.6712 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.3284 -0.9220 0.1497 O 0 0 0 0 0 0 0 0 0 0 0 0
-9.0139 -0.4902 1.2910 C 0 0 0 0 0 0 0 0 0 0 0 0
10.4380 -1.0413 0.1622 H 0 0 0 0 0 0 0 0 0 0 0 0
9.1925 -0.4333 -1.0685 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9571 -0.4760 1.9434 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7327 1.2251 -2.1434 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6901 2.0986 -0.5877 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4670 0.2357 0.4852 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4314 -0.6567 -1.1258 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2922 2.3668 -1.7721 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0524 1.7311 -1.4148 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1843 -1.7654 0.5899 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5732 -1.1286 0.2321 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5534 -1.0892 -2.2800 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.9203 -1.6402 -1.9001 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.8677 0.4803 1.7675 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.4662 1.0416 1.3860 H 0 0 0 0 0 0 0 0 0 0 0 0
-10.0276 -0.9761 1.3049 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.1636 0.6232 1.2240 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.4746 -0.6871 2.2346 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