Monomers

N-Octadecylacrylamide

Identifiers

IUPAC name
N-octadecylprop-2-enamide
InchI
InChI=1S/C21H41NO/c1-3-5-6-7-8-9-10-11-12-13-14-15-16-17-18-19-20-22-21(23)4-2/h4H,2-3,5-20H2,1H3,(H,22,23)
InchI Key
CNWVYEGPPMQTKA-UHFFFAOYSA-N
SMILES
CCCCCCCCCCCCCCCCCCNC(=O)C=C
Canonical SMILES
CCCCCCCCCCCCCCCCCCNC(=O)C=C
Isomeric SMILES
CCCCCCCCCCCCCCCCCCNC(=O)C=C
Resources

Structures

2D Structure
3D Structure

Molecular Formula and Computed Descriptors

Molecular Formula
C21H41NO
Heavy Atom Count
23
Molecular Weight
323.565
Exact Molecular Weight
323.3188
Valence Electrons
136
Radical Electrons
0
tPSA
29.1
MolLogP
6.5501
H Bond Acceptors
1
H Bond Donors
1
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0

MOL File


     RDKit          3D

 64 63  0  0  0  0  0  0  0  0999 V2000
   -8.6530   -2.3025   -2.9241 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3501   -2.2682   -2.1452 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6055   -1.4708   -0.9069 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3376   -1.3775   -0.0521 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2277   -0.7205   -0.7929 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9950   -0.6534    0.0893 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2732    0.1424    1.3045 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0648    0.2275    2.1919 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9270    0.8964    1.4648 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7267    1.0110    2.4254 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.4440    1.6713    1.7470 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.9558    0.9187    0.5473 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4217   -0.4755    0.9201 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.5363   -0.4287    1.9383 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7581    0.2909    1.4783 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3526   -0.3879    0.2783 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5963    0.4189   -0.1372 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2071   -0.2832   -1.3043 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3764    0.4836   -1.7363 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4830    0.7708   -0.9128 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4766    0.3406    0.2983 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.6298    1.5271   -1.3662 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.7407    1.9766   -2.5760 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.6014   -3.0331   -3.7597 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.4973   -2.5268   -2.2567 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7741   -1.2924   -3.3992 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9751   -3.2703   -1.9093 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6081   -1.7493   -2.7877 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.8686   -0.4227   -1.1664 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3792   -1.9176   -0.2513 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6671   -0.8603    0.8683 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9885   -2.3936    0.2435 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.4914    0.3108   -1.1508 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9152   -1.3295   -1.6825 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1139   -0.3163   -0.4941 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8147   -1.7168    0.4136 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4894    1.2093    0.9948 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1219   -0.2587    1.9024 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2900    0.8352    3.1127 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7170   -0.7851    2.5212 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6402    0.2583    0.6154 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2379    1.8929    1.0999 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5233   -0.0001    2.7960 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0216    1.6800    3.2689 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.0496    2.6524    1.3468 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2245    1.9478    2.4654 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7601    1.5124    0.0922 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1305    0.8160   -0.1781 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.5961   -1.0691    1.3160 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7942   -0.9680    0.0065 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2172   -0.0295    2.9088 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.8238   -1.5097    2.1119 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.4773    1.3278    1.1883 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4955    0.4099    2.3068 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6403   -1.4331    0.4897 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6362   -0.3639   -0.5826 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3194    1.4555   -0.3244 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2355    0.4300    0.7754 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5053   -0.3805   -2.1323 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5956   -1.2874   -1.0255 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3798    0.8370   -2.7198 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.4492    1.7345   -0.6586 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.6043    2.5377   -2.8826 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9835    1.8058   -3.3123 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  1  0
 15 16  1  0
 16 17  1  0
 17 18  1  0
 18 19  1  0
 19 20  1  0
 20 21  2  0
 20 22  1  0
 22 23  2  3
  1 24  1  0
  1 25  1  0
  1 26  1  0
  2 27  1  0
  2 28  1  0
  3 29  1  0
  3 30  1  0
  4 31  1  0
  4 32  1  0
  5 33  1  0
  5 34  1  0
  6 35  1  0
  6 36  1  0
  7 37  1  0
  7 38  1  0
  8 39  1  0
  8 40  1  0
  9 41  1  0
  9 42  1  0
 10 43  1  0
 10 44  1  0
 11 45  1  0
 11 46  1  0
 12 47  1  0
 12 48  1  0
 13 49  1  0
 13 50  1  0
 14 51  1  0
 14 52  1  0
 15 53  1  0
 15 54  1  0
 16 55  1  0
 16 56  1  0
 17 57  1  0
 17 58  1  0
 18 59  1  0
 18 60  1  0
 19 61  1  0
 22 62  1  0
 23 63  1  0
 23 64  1  0
M  END

Similar Monomers

Structure
Similarity
IUPAC name
MF
Copolymers