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
    4.0349   -1.0682   -0.9626 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1965   -0.2693   -0.0443 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6775    0.1551    1.0941 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8329    0.0433   -0.4122 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3722   -0.3654   -1.5065 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9809    0.7853    0.3892 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2980    1.0492   -0.0110 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5732    2.1837   -0.7441 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8797    2.4087   -1.1261 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8721    1.5157   -0.7775 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5996    0.3725   -0.0396 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2894    0.1511    0.3409 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9946   -0.9939    1.0841 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9725   -1.8899    1.4373 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2764   -1.6548    1.0497 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5804   -0.5269    0.3151 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9985   -0.6433   -2.0044 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0900   -1.0164   -0.6305 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6490   -2.1155   -0.9899 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6957   -0.0847    1.3567 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0841    0.7438    1.7878 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1823    2.9013   -1.0322 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1555    3.2847   -1.7042 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9043    1.6657   -1.0626 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0202   -1.1673    1.3800 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7483   -2.7865    2.0180 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0699   -2.3501    1.3173 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6008   -0.3278    0.0027 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