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
   -6.0265    1.7265    1.4781 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4969    0.3921    1.9814 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7242   -0.6195    0.8888 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0169   -0.2547   -0.3788 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.5223   -0.1653   -0.1430 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8601    0.2044   -1.4518 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3888    0.2998   -1.2291 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7410   -0.9749   -0.7426 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.7526   -0.6456   -0.5915 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.5274   -1.8228   -0.1127 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9887   -1.4283    0.0090 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1777   -0.3016    0.9804 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5429    0.0109    1.0600 O   0  0  0  0  0  0  0  0  0  0  0  0
    5.2620    0.4670   -0.0217 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.7427    0.6377   -1.1499 O   0  0  0  0  0  0  0  0  0  0  0  0
    6.6911    0.7498    0.2098 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2558    0.5765    1.3896 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.4835    1.2416   -0.9408 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1755    2.3319    1.1326 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6138    2.2154    2.2741 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7196    1.5777    0.6240 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.0704    0.0778    2.8800 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4415    0.4792    2.2459 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3551   -1.6242    1.2007 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8229   -0.6454    0.6871 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.3911    0.7148   -0.7398 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1880   -1.0708   -1.1146 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1148   -1.1219    0.2438 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2996    0.6575    0.5663 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1447   -0.4749   -2.2691 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2141    1.2542   -1.6738 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1552    1.1224   -0.5151 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9116    0.6301   -2.1979 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9137   -1.8274   -1.3970 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0934   -1.1648    0.3051 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.7643    0.2269    0.0940 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1094   -0.3387   -1.5761 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4577   -2.6161   -0.8684 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.1951   -2.2358    0.8439 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5987   -2.3136    0.3155 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.3398   -1.1360   -0.9754 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8042   -0.6590    1.9636 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.6655    0.6301    0.6617 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6530    0.2161    2.2126 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2914    0.7833    1.5502 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9669    1.0670   -1.8833 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.6226    2.3552   -0.8143 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.5088    0.7952   -0.9129 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