Monomers

4-[2-(Methacryloyloxy)ethoxy]benzoic acid 4-methoxyphenyl ester

Identifiers

IUPAC name
(4-methoxyphenyl) 4-[2-(2-methylprop-2-enoyloxy)ethoxy]benzoate
InchI
InChI=1S/C20H20O6/c1-14(2)19(21)25-13-12-24-17-6-4-15(5-7-17)20(22)26-18-10-8-16(23-3)9-11-18/h4-11H,1,12-13H2,2-3H3
InchI Key
OIRKPCZRJHIGSG-UHFFFAOYSA-N
SMILES
COc1ccc(cc1)OC(=O)c1ccc(cc1)OCCOC(=O)C(=C)C
Canonical SMILES
CC(=C)C(=O)OCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)OC
Isomeric SMILES
CC(=C)C(=O)OCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)OC
Resources

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C20H20O6
Heavy Atom Count
26
Molecular Weight
356.374
Exact Molecular Weight
356.126
Valence Electrons
136
Radical Electrons
0
tPSA
71.06
MolLogP
3.4125
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

 46 47  0  0  0  0  0  0  0  0999 V2000
    8.6511   -1.9735    3.2204 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9953   -2.3871    2.0373 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6558   -2.0650    1.8565 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9802   -2.4561    0.7055 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.6506   -2.1558    0.4891 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9267   -1.4460    1.4172 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5807   -1.0495    2.5657 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9228   -1.3531    2.7832 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5887   -1.1093    1.2654 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.1904    0.0918    0.6617 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1499    0.8223    0.2772 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.8038    0.4553    0.4973 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4331    1.6338   -0.0932 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8886    2.0069   -0.2635 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8562    1.1355    0.1903 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5335   -0.0570    0.7885 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1823   -0.3921    0.9392 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1828    1.5370    0.0058 O   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2074    0.6532    0.4660 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5270    1.3172    0.1489 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7187    1.5607   -1.2026 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7484    0.6323   -2.2135 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5851   -0.5774   -1.8958 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9583    0.9945   -3.6103 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9770    0.0580   -4.5418 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1494    2.4121   -3.9746 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.6485   -2.4693    3.3255 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.8527   -0.8826    3.1839 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0435   -2.1632    4.1354 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5675   -3.0219   -0.0283 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1496   -2.4790   -0.4276 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0256   -0.4876    3.3113 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.4143   -1.0253    3.7028 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1850    2.3430   -0.4618 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1347    2.9468   -0.7350 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2914   -0.7178    1.1330 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1138   -1.3211    1.4045 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0624    0.5771    1.5604 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0559   -0.2965   -0.0705 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3244    0.7162    0.6277 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5031    2.3153    0.6694 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8391   -0.9856   -4.2941 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.1308    0.3191   -5.5695 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2577    2.5691   -4.0592 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7473    3.0988   -3.2011 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6682    2.6757   -4.9405 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  2  0
  4  5  1  0
  5  6  2  0
  6  7  1  0
  7  8  2  0
  6  9  1  0
  9 10  1  0
 10 11  2  0
 10 12  1  0
 12 13  2  0
 13 14  1  0
 14 15  2  0
 15 16  1  0
 16 17  2  0
 15 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  1  0
 21 22  1  0
 22 23  2  0
 22 24  1  0
 24 25  2  3
 24 26  1  0
  8  3  1  0
 17 12  1  0
  1 27  1  0
  1 28  1  0
  1 29  1  0
  4 30  1  0
  5 31  1  0
  7 32  1  0
  8 33  1  0
 13 34  1  0
 14 35  1  0
 16 36  1  0
 17 37  1  0
 19 38  1  0
 19 39  1  0
 20 40  1  0
 20 41  1  0
 25 42  1  0
 25 43  1  0
 26 44  1  0
 26 45  1  0
 26 46  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers