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
8.2495 1.9583 2.3070 C 0 0 0 0 0 0 0 0 0 0 0 0
7.5490 2.2103 1.2408 C 0 0 0 0 0 0 0 0 0 0 0 0
6.7200 1.1484 0.6432 C 0 0 0 0 0 0 0 0 0 0 0 0
6.0618 1.4328 -0.3818 O 0 0 0 0 0 0 0 0 0 0 0 0
6.6497 -0.1149 1.1658 O 0 0 0 0 0 0 0 0 0 0 0 0
5.8479 -1.1004 0.5740 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3763 -0.7515 0.5579 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5992 -1.7507 -0.0367 O 0 0 0 0 0 0 0 0 0 0 0 0
2.2377 -1.5954 -0.1346 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4439 -2.5548 -0.7116 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0812 -2.3802 -0.8001 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5099 -1.2289 -0.3058 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2932 -0.2464 0.2838 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6474 -0.4572 0.3533 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9513 -1.0591 -0.4067 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6455 -1.9488 -0.9364 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5210 0.0982 0.0932 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.8938 0.2511 -0.0073 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4374 0.8532 -1.1203 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.8019 1.0312 -1.2717 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.6277 0.5840 -0.2634 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.1208 -0.0282 0.8750 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.7537 -0.1818 0.9776 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.9876 0.7458 -0.3834 O 0 0 0 0 0 0 0 0 0 0 0 0
-8.5611 1.3614 -1.5189 C 0 0 0 0 0 0 0 0 0 0 0 0
8.2215 0.9760 2.7492 H 0 0 0 0 0 0 0 0 0 0 0 0
8.8683 2.7185 2.7688 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5775 3.1994 0.7960 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0093 -2.0540 1.1415 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1914 -1.3506 -0.4701 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1034 -0.6066 1.6473 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1715 0.2279 0.0947 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8454 -3.4776 -1.1170 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5840 -3.1250 -1.2543 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1655 0.6597 0.6736 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2424 0.3379 0.8234 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7794 1.1968 -1.8982 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.2241 1.5033 -2.1450 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.8256 -0.3525 1.6218 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3667 -0.6581 1.8646 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.4053 2.4539 -1.4784 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.1634 0.9562 -2.4654 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.6621 1.1182 -1.5028 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