Monomers

4-Benzoyl-3-hydroxyphenyl methacrylate

Identifiers

IUPAC name
(4-benzoyl-3-hydroxyphenyl) 2-methylprop-2-enoate
InchI
InChI=1S/C17H14O4/c1-11(2)17(20)21-13-8-9-14(15(18)10-13)16(19)12-6-4-3-5-7-12/h3-10,18H,1H2,2H3
InchI Key
IMNBHNRXUAJVQE-UHFFFAOYSA-N
SMILES
CC(=C)C(=O)Oc1ccc(c(c1)O)C(=O)c1ccccc1
Canonical SMILES
CC(=C)C(=O)OC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O
Isomeric SMILES
CC(=C)C(=O)OC1=CC(=C(C=C1)C(=O)C2=CC=CC=C2)O
Resources

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C17H14O4
Heavy Atom Count
21
Molecular Weight
282.295
Exact Molecular Weight
282.0892
Valence Electrons
106
Radical Electrons
0
tPSA
63.6
MolLogP
3.1047
H Bond Acceptors
4
H Bond Donors
1
Aliphatic Carbocycles
0
Aromatic Carbocycles
2
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
2

MOL File


     RDKit          3D

 35 36  0  0  0  0  0  0  0  0999 V2000
    5.8558    0.2064   -1.0024 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2168   -0.1114    0.3042 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9826   -0.2115    1.3590 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7890   -0.3043    0.4092 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2270   -0.5720    1.4995 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9401   -0.2038   -0.7083 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5755   -0.3976   -0.5548 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7689    0.6903   -0.3085 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6190    0.5604   -0.1438 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2123   -0.6736   -0.2271 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3869   -1.7777   -0.4775 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9696   -1.6292   -0.6352 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9511   -3.0383   -0.5669 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6164   -0.9006   -0.0237 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0115   -2.1123    0.1639 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6476    0.0908   -0.0045 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6319    1.2506   -0.7247 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6357    2.1963   -0.6289 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.6876    1.9875    0.2040 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7539    0.8407    0.9482 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7490   -0.0927    0.8444 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.9564    1.3250   -1.0387 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8615   -0.2890   -1.0284 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2626   -0.1174   -1.8652 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0543   -0.0852    1.3859 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5232   -0.4436    2.3191 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1675    1.6992   -0.2306 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1821    1.4640    0.0762 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.5944   -2.4910   -0.8278 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3632   -3.8306   -0.7460 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8080    1.4241   -1.4321 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5731    3.0868   -1.2148 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4725    2.7453    0.2697 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6114    0.7041    1.6058 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8320   -0.9896    1.4475 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  2  3
  2  4  1  0
  4  5  2  0
  4  6  1  0
  6  7  1  0
  7  8  2  0
  8  9  1  0
  9 10  2  0
 10 11  1  0
 11 12  2  0
 11 13  1  0
 10 14  1  0
 14 15  2  0
 14 16  1  0
 16 17  2  0
 17 18  1  0
 18 19  2  0
 19 20  1  0
 20 21  2  0
 12  7  1  0
 21 16  1  0
  1 22  1  0
  1 23  1  0
  1 24  1  0
  3 25  1  0
  3 26  1  0
  8 27  1  0
  9 28  1  0
 12 29  1  0
 13 30  1  0
 17 31  1  0
 18 32  1  0
 19 33  1  0
 20 34  1  0
 21 35  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers