Monomers

Naphthyl methacrylate

Identifiers

IUPAC name
naphthalen-1-yl 2-methylprop-2-enoate
InchI
InChI=1S/C14H12O2/c1-10(2)14(15)16-13-9-5-7-11-6-3-4-8-12(11)13/h3-9H,1H2,2H3
InchI Key
HVYCQBKSRWZZGX-UHFFFAOYSA-N
SMILES
CC(=C)C(=O)Oc1cccc2c1cccc2
Canonical SMILES
CC(=C)C(=O)OC1=CC=CC2=CC=CC=C21
Isomeric SMILES
CC(=C)C(=O)OC1=CC=CC2=CC=CC=C21
Resources
cid=

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C14H12O2
Heavy Atom Count
16
Molecular Weight
212.248
Exact Molecular Weight
212.0837
Valence Electrons
80
Radical Electrons
0
tPSA
26.3
MolLogP
3.3213
H Bond Acceptors
2
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

 28 29  0  0  0  0  0  0  0  0999 V2000
    4.2271   -0.8073    0.4788 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1213    0.0880    0.8781 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3320    1.2539    1.4171 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7705   -0.3713    0.6511 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5027   -1.4957    0.1305 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.7007    0.4126    0.9995 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6181   -0.0107    0.7895 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2523   -0.7223    1.8035 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5674   -1.1526    1.6119 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2182   -0.8771    0.4451 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5695   -0.1751   -0.5352 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2640    0.2669   -0.3775 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.6454    0.9666   -1.3790 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3019    1.2497   -2.5676 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5943    0.8214   -2.7438 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1929    0.1215   -1.7247 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.2266   -0.3810    0.6562 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.0990   -1.0773   -0.5963 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1377   -1.7329    1.1098 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3150    1.6334    1.6032 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.4899    1.8608    1.6867 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7036   -0.9116    2.6929 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0389   -1.7019    2.4103 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2313   -1.2195    0.3216 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3721    1.3136   -1.2618 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7734    1.7982   -3.3150 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1047    1.0509   -3.6884 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2188   -0.2014   -1.9022 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
 12 13  1  0
 13 14  2  0
 14 15  1  0
 15 16  2  0
 12  7  1  0
 16 11  1  0
  1 17  1  0
  1 18  1  0
  1 19  1  0
  3 20  1  0
  3 21  1  0
  8 22  1  0
  9 23  1  0
 10 24  1  0
 13 25  1  0
 14 26  1  0
 15 27  1  0
 16 28  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers