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
8.6062 2.2913 0.7451 C 0 0 0 0 0 0 0 0 0 0 0 0
9.0257 1.1555 0.2234 C 0 0 0 0 0 0 0 0 0 0 0 0
8.0939 0.1135 -0.1803 C 0 0 0 0 0 0 0 0 0 0 0 0
8.4691 -0.9771 -0.6796 O 0 0 0 0 0 0 0 0 0 0 0 0
6.7087 0.2651 -0.0349 O 0 0 0 0 0 0 0 0 0 0 0 0
5.8094 -0.7564 -0.4315 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4134 -0.2575 -0.1333 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4212 -1.1730 -0.4780 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0987 -0.8612 -0.2661 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1285 -1.7707 -0.6094 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2155 -1.4734 -0.4025 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6105 -0.2671 0.1487 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3886 0.6341 0.4867 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7359 0.3441 0.2829 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0155 0.0271 0.3577 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4020 1.1117 0.8551 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.9545 -0.9182 -0.0031 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.3066 -0.6441 0.1941 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.0677 -0.0346 -0.7703 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.4202 0.2512 -0.6004 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.0028 -0.1014 0.5962 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.2616 -0.7207 1.5960 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.9168 -0.9861 1.3830 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.3381 0.1641 0.8032 O 0 0 0 0 0 0 0 0 0 0 0 0
-9.1037 0.7909 -0.1992 C 0 0 0 0 0 0 0 0 0 0 0 0
9.2366 3.0883 1.0585 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5235 2.4380 0.8710 H 0 0 0 0 0 0 0 0 0 0 0 0
10.0817 0.9941 0.0925 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9329 -1.0085 -1.5064 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9700 -1.6503 0.2204 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2844 0.6800 -0.7486 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3920 0.0626 0.9203 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3421 -2.7375 -1.0453 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9643 -2.1831 -0.6709 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0995 1.5769 0.9164 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4580 1.1031 0.5744 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5819 0.2311 -1.7011 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.9831 0.7368 -1.3958 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.7750 -0.9713 2.5084 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3544 -1.4695 2.1733 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.7916 1.8564 -0.3347 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.9646 0.2925 -1.2033 H 0 0 0 0 0 0 0 0 0 0 0 0
-10.1896 0.7535 0.0169 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