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
    3.9418    1.4534   -0.8010 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1364    0.5209    0.0254 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.6136    0.0070    1.1430 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8014    0.1847   -0.4276 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3180    0.6554   -1.4843 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0422   -0.6861    0.3390 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2248   -1.0270   -0.0581 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4055   -2.1253   -0.8710 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.7035   -2.4478   -1.2585 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7841   -1.6954   -0.8455 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5531   -0.5911   -0.0222 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2748   -0.2559    0.3720 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0335    0.8487    1.1967 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0698    1.6223    1.6303 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.3497    1.2918    1.2392 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5878    0.2015    0.4252 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5225    0.8708   -1.5602 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.2455    2.1490   -1.3146 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6319    2.0086   -0.1204 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0735   -0.6660    1.7691 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6232    0.2653    1.4793 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4160   -2.7384   -1.2145 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8476   -3.3085   -1.8958 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8136   -1.9319   -1.1389 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0117    1.0911    1.4935 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9112    2.4786    2.2662 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2003    1.8883    1.5673 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5952   -0.0642    0.1133 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