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
    3.5716    1.0696   -1.2381 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8730   -0.2073   -1.4913 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.3122   -1.0099   -2.4320 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.7149   -0.5506   -0.6961 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1347   -1.6441   -0.9291 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.2142    0.2667    0.3094 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.1118   -0.1298    1.0185 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2000   -0.8721    2.1725 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9518   -1.2368    2.8359 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2183   -0.9013    2.4135 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2906   -0.1470    1.2395 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1464    0.2252    0.5648 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2461    0.9808   -0.6090 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5025    1.3297   -1.0533 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6408    0.9504   -0.3682 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5579    0.2060    0.7896 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8619    1.8931   -1.5160 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8434    1.1979   -0.1672 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4720    1.2015   -1.8480 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1783   -0.7827   -3.0470 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.7920   -1.9548   -2.6166 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1874   -1.1735    2.5643 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8590   -1.8309    3.7578 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1193   -1.1898    2.9374 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3289    1.2683   -1.1327 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5530    1.9143   -1.9637 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6173    1.2364   -0.7366 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4356   -0.1093    1.3536 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