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
    4.0935    0.6826   -1.0606 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1880    0.5702    0.0859 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.5551    1.0528    1.2467 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8937   -0.0770   -0.0847 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5383   -0.5407   -1.1953 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.9862   -0.2156    0.9678 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2388   -0.8377    0.7707 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4077   -2.1946    0.9437 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6458   -2.7867    0.7387 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7200   -2.0127    0.3581 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5780   -0.6580    0.1790 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3300   -0.0825    0.3889 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1906    1.2617    0.2108 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2341    2.0763   -0.1689 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4677    1.5004   -0.3753 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6382    0.1485   -0.2034 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6580    1.2797   -1.9071 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0635    1.1346   -0.7696 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3548   -0.3524   -1.4305 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4958    1.5312    1.4006 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8863    0.9699    2.0942 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4327   -2.8171    1.2442 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7873   -3.8513    0.8723 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.6948   -2.4517    0.1925 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2112    1.6958    0.3783 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0931    3.1602   -0.3057 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3049    2.1243   -0.6752 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.6036   -0.3099   -0.3638 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