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
   -8.6697    2.3838   -1.8687 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3658    1.8416   -0.4709 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1839    0.9096   -0.6262 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7782    0.2994    0.7001 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5976   -0.6066    0.4256 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.0957   -1.2800    1.6800 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.9240   -2.1550    1.2928 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7973   -1.3457    0.6696 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2778   -0.2993    1.6249 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.1847    0.4760    0.9470 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0245   -0.3843    0.5317 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0215    0.5015   -0.1226 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2256   -0.2852   -0.5820 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.9185   -0.9892    0.5409 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1236   -1.7895    0.1229 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1348   -0.8675   -0.5031 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.3782   -1.6409   -0.9235 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3430   -0.6711   -1.5420 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.7222    0.3329   -0.5733 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.6263    1.3860   -0.9115 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0506    1.3551   -2.1074 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.0453    2.4191    0.0081 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6219    2.4711    1.2428 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.2447    3.3160   -1.7566 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7380    2.5811   -2.4301 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.2140    1.5981   -2.4193 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0549    2.6563    0.2085 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.2434    1.3099   -0.0695 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3118    1.4965   -0.9801 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.3595    0.0961   -1.3389 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5608    1.0932    1.4223 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6345   -0.3454    1.0537 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8178    0.0165   -0.0478 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9502   -1.4105   -0.2507 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9199   -1.9532    2.0407 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8043   -0.5613    2.4664 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4800   -2.6729    2.1702 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.2817   -2.8565    0.5195 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.9660   -2.1043    0.5455 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0292   -0.9709   -0.3291 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.0920    0.4025    1.9474 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8886   -0.8577    2.5232 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7620    1.2743    1.6125 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.6168    1.0375    0.0796 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.4242   -0.8632    1.4208 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3828   -1.1605   -0.1759 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3545    1.2665    0.5972 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.6113    1.0318   -0.9953 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8313   -1.0247   -1.3324 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.9037    0.3649   -1.1591 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.2134   -1.6954    1.0563 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1943   -0.2474    1.3179 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.8247   -2.5855   -0.6184 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.5543   -2.2955    1.0203 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4069   -0.0854    0.1969 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.7025   -0.4150   -1.4401 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8585   -2.0231    0.0102 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.1398   -2.4841   -1.5812 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.8523   -0.1748   -2.4150 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.2215   -1.2647   -1.8846 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3454    0.2910    0.3761 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.7282    3.1743   -0.3268 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9335    3.2456    1.9391 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.9401    1.7384    1.6191 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