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
    6.1536   -0.9435    0.8063 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2609   -0.0303    0.0544 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.7466    1.0058   -0.5991 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.8388   -0.2957    0.0486 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3562   -1.2765    0.6650 O   0  0  0  0  0  0  0  0  0  0  0  0
    2.9423    0.5121   -0.6324 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.5743    0.2483   -0.6319 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7314    0.8018    0.3031 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6457    0.5458    0.3181 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1973   -0.2943   -0.6401 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3313   -0.8458   -1.5782 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0257   -0.5844   -1.5797 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9049   -1.6905   -2.5359 O   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5904   -0.6365   -0.6549 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9387   -1.6322   -1.4063 O   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6766   -0.0206    0.0604 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7324    1.2957    0.4189 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7927    1.8268    1.1537 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8386    1.0199    1.5459 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.8116   -0.3057    1.1995 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7487   -0.8143    0.4699 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5243   -1.7294    0.0944 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0589   -0.4324    1.1918 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6246   -1.4047    1.6805 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.1361    1.6886   -1.1536 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8176    1.2112   -0.6001 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1834    1.4589    1.0447 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2302    0.9991    1.0981 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6465   -1.0503   -2.3432 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3443   -2.1361   -3.2603 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.9637    2.0069    0.1235 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8167    2.8744    1.4284 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6624    1.4503    2.1211 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6328   -0.9588    1.5017 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7622   -1.8639    0.2150 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