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
    3.6838   -0.2115   -1.3891 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1320    0.6830   -0.3622 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7995    1.7274    0.0277 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8403    0.3867    0.2072 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3863    1.1667    1.0859 O   0  0  0  0  0  0  0  0  0  0  0  0
    1.0811   -0.7216   -0.1752 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1444   -0.8824    0.4573 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2703   -1.6199    1.6426 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4839   -1.7748    2.2622 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5966   -1.1974    1.7122 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4947   -0.4565    0.5291 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2600   -0.3026   -0.0956 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1658    0.4350   -1.2711 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2883    1.0186   -1.8276 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5174    0.8717   -1.2156 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5794    0.1356   -0.0524 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.4354    0.3154   -2.0118 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2496   -1.0177   -0.8430 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9135   -0.7343   -1.9888 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4368    2.4286    0.7896 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7634    1.9283   -0.4126 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6337   -2.0447    2.0207 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5650   -2.3388    3.1640 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5812   -1.2815    2.1503 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1963    0.5339   -1.7275 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2438    1.5965   -2.7396 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4204    1.3280   -1.6429 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5479    0.0284    0.4165 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