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
   -6.5181    3.7314    0.2692 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1949    3.2717   -0.2607 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2184    1.7608   -0.5627 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5219    0.9873    0.6867 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5710   -0.4716    0.4093 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2119   -0.9412   -0.1306 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2396   -2.4073   -0.3894 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0185   -3.0029   -0.9170 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8156   -3.0936   -0.0878 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2541   -1.8577    0.4675 C   0  0  0  0  0  0  0  0  0  0  0  0
    0.0681   -2.1903    1.1833 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0962   -2.7813    0.2852 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.4709   -1.8911   -0.8664 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0293   -0.5726   -0.4647 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2886   -0.6408    0.3589 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7563    0.7676    0.6970 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.0023    0.7322    1.5158 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1722    0.0631    0.8680 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5927    0.6603   -0.3609 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.0227    2.0138   -0.4018 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.0093    2.6454    0.7043 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.4586    2.6596   -1.6336 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.8548    3.9116   -1.6632 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3292    3.0117   -0.0372 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4949    3.8428    1.3589 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8226    4.7014   -0.2045 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.4080    3.4067    0.5071 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8935    3.8152   -1.1665 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9700    1.5363   -1.3453 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2125    1.5352   -0.9920 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7418    1.2348    1.4431 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5317    1.3592    1.0316 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.7204   -1.0560    1.3519 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3449   -0.7344   -0.3327 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4596   -0.5519    0.5302 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0638   -0.4158   -1.1393 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0974   -2.6446   -1.1120 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5420   -2.9185    0.5739 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.2529   -4.0489   -1.3428 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7221   -2.4817   -1.9118 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0187   -3.7773    0.8197 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.0166   -3.6964   -0.6348 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.2022   -0.9805   -0.1533 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8956   -1.5934    1.3884 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4419   -1.2762    1.6873 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1987   -2.9673    1.9435 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.8713   -3.7974   -0.0405 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.0326   -2.8776    0.9243 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2670   -2.4318   -1.4368 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6284   -1.7443   -1.5555 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1971    0.0693   -1.3411 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.2388   -0.0501    0.1442 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.1123   -1.1241   -0.2023 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1467   -1.2340    1.2837 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8062    1.4107   -0.1803 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9517    1.1925    1.3551 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2331    1.7356    1.9128 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7620    0.1150    2.4325 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9858    0.0415    1.6374 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9241   -1.0137    0.7065 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.5937    0.1140   -1.2604 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.4531    2.0878   -2.5422 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.1657    4.3316   -2.6083 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.8695    4.5205   -0.7426 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