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
    2.9551    0.7693    2.9218 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.3839   -0.2742    2.0416 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.0361   -1.3866    1.8043 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0808   -0.0439    1.4415 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4324    1.0133    1.6510 O   0  0  0  0  0  0  0  0  0  0  0  0
    0.4716   -0.9770    0.6000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7669   -0.7287    0.0456 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9313   -1.1063    0.7006 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1194   -0.8262    0.0883 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2400   -0.1956   -1.1329 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0466    0.1690   -1.7611 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8357   -0.0990   -1.1707 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.3261    0.2724   -1.8141 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.2290    0.8985   -3.0253 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9754    1.1717   -3.6253 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1333    0.7982   -2.9777 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.4473    1.5692    2.3306 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7179    0.2833    3.5620 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1095    1.1664    3.5315 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9987   -1.5372    2.2582 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6533   -2.1681    1.1700 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8238   -1.5995    1.6566 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0269   -1.1215    0.6007 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2053    0.0130   -1.5939 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2636    0.0519   -1.3317 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1291    1.1975   -3.5454 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0321    1.6767   -4.6010 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0976    1.0136   -3.4516 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