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
    3.7036   -0.1950   -1.0133 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1948    0.5814    0.1742 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9263    1.4639    0.7917 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8211    0.2978    0.6126 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3166    0.8988    1.5937 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0249   -0.6354   -0.0277 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2741   -0.9213    0.3661 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4906   -1.9161    1.2928 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7946   -2.1785    1.6657 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8177   -1.4420    1.1015 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5787   -0.4449    0.1703 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2900   -0.1817   -0.2017 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0072    0.8086   -1.1312 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0120    1.5551   -1.7063 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3169    1.2823   -1.3239 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5836    0.2973   -0.4009 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7243   -0.5565   -0.6997 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8024    0.4868   -1.8912 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0700   -1.0570   -1.2184 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5106    1.9908    1.6370 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.9352    1.6533    0.4478 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.3515   -2.4700    1.7096 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9914   -2.9583    2.3949 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8289   -1.6403    1.3860 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0243    0.9894   -1.4019 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7419    2.3066   -2.4174 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0805    1.8858   -1.7939 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5973    0.0989   -0.1161 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