Monomers

Dodecyl methacrylate

Identifiers

IUPAC name
dodecyl 2-methylprop-2-enoate
InchI
InChI=1S/C16H30O2/c1-4-5-6-7-8-9-10-11-12-13-14-18-16(17)15(2)3/h2,4-14H2,1,3H3
InchI Key
GMSCBRSQMRDRCD-UHFFFAOYSA-N
SMILES
CCCCCCCCCCCCOC(=O)C(=C)C
Canonical SMILES
CCCCCCCCCCCCOC(=O)C(=C)C
Isomeric SMILES
CCCCCCCCCCCCOC(=O)C(=C)C
Resources

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C16H30O2
Heavy Atom Count
18
Molecular Weight
254.414
Exact Molecular Weight
254.2246
Valence Electrons
106
Radical Electrons
0
tPSA
26.3
MolLogP
5.0266
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0

MOL File


     RDKit          3D

 48 47  0  0  0  0  0  0  0  0999 V2000
    6.7960    1.4547   -0.5837 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4256    0.9439   -0.0739 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4680   -0.5191    0.1473 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.2945   -1.1912    0.7111 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9764   -1.2103    0.0738 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.1878    0.0041   -0.1323 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.8682   -0.3230   -0.8077 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0231   -1.2605   -0.0132 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2666   -0.6897    1.3544 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9797    0.6102    1.2652 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3108    0.5350    0.5432 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2648   -0.4038    1.2140 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4794   -0.4601    0.5225 O   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2515    0.6751    0.4082 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8945    1.7663    0.9161 O   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5214    0.6252   -0.3194 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2401    1.7235   -0.4141 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9312   -0.6632   -0.9125 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3247    0.6506   -1.1347 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.4387    1.7521    0.2598 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6087    2.3517   -1.2096 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2125    1.4998    0.8416 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7137    1.1672   -0.9106 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3465   -0.7936    0.8395 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7936   -1.0662   -0.8009 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2189   -0.9154    1.8237 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6016   -2.3046    0.8112 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0887   -1.7413   -0.9247 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2975   -1.9440    0.6384 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6340    0.8200   -0.7382 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9613    0.5026    0.8622 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0449   -0.6926   -1.8502 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.2853    0.6325   -0.9669 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5095   -2.2529    0.0540 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9778   -1.4191   -0.5509 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.8369   -1.4575    1.9421 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6570   -0.5381    1.9480 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3381    1.3618    0.7850 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1404    0.9588    2.3256 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1422    0.2728   -0.5305 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6750    1.5785    0.5240 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8248   -1.4022    1.4079 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5266    0.0097    2.2340 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9242    2.6417    0.0219 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1702    1.6906   -0.9460 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0606   -1.3193   -1.1181 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6153   -1.2318   -0.2449 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.4046   -0.4290   -1.8972 H   0  0  0  0  0  0  0  0  0  0  0  0
  1  2  1  0
  2  3  1  0
  3  4  1  0
  4  5  1  0
  5  6  1  0
  6  7  1  0
  7  8  1  0
  8  9  1  0
  9 10  1  0
 10 11  1  0
 11 12  1  0
 12 13  1  0
 13 14  1  0
 14 15  2  0
 14 16  1  0
 16 17  2  3
 16 18  1  0
  1 19  1  0
  1 20  1  0
  1 21  1  0
  2 22  1  0
  2 23  1  0
  3 24  1  0
  3 25  1  0
  4 26  1  0
  4 27  1  0
  5 28  1  0
  5 29  1  0
  6 30  1  0
  6 31  1  0
  7 32  1  0
  7 33  1  0
  8 34  1  0
  8 35  1  0
  9 36  1  0
  9 37  1  0
 10 38  1  0
 10 39  1  0
 11 40  1  0
 11 41  1  0
 12 42  1  0
 12 43  1  0
 17 44  1  0
 17 45  1  0
 18 46  1  0
 18 47  1  0
 18 48  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers