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
   -7.7977    1.4025    1.5201 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7794   -0.0779    1.6672 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5580   -0.7496    1.0587 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2861   -0.2803    1.6706 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1113   -0.9833    1.0585 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0104   -0.7495   -0.4030 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8822    0.7121   -0.7070 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6831    1.2946   -0.0320 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4287    0.5910   -0.5250 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2005    1.1613    0.0993 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0427    0.4891   -0.4334 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.0657   -0.9489   -0.1438 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.2323   -1.7733   -0.4890 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.7084   -1.9723   -1.8518 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.1854   -0.8325   -2.6567 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.3263   -0.0696   -2.0185 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.5188   -0.9645   -1.7988 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.6337   -0.1865   -1.1671 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2584    0.3733    0.1195 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.2488    1.1268    0.7942 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.4014    1.2812    0.2614 O   0  0  0  0  0  0  0  0  0  0  0  0
    7.0190    1.7463    2.0872 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8725    1.6579    2.7361 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.4135    1.7269    0.6306 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8375    1.9053    1.4466 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.3333    1.8777    2.3937 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.9534   -0.4171    2.6988 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.6538   -0.4766    1.0732 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.5432   -0.5978   -0.0450 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6764   -1.8380    1.2335 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1333    0.8107    1.5219 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.2677   -0.5373    2.7624 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1800   -0.6576    1.6112 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.1789   -2.0859    1.2395 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1303   -1.3043   -0.8186 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.9000   -1.1969   -0.9357 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.7867    0.8639   -1.8291 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8118    1.2607   -0.4048 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6162    2.3859   -0.2861 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.7200    1.2341    1.0572 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3859    0.6985   -1.6172 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.4715   -0.4894   -0.2427 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0827    2.2529   -0.1567 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2238    1.1303    1.2106 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.0107    0.7555   -1.5380 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8980    1.0146    0.0526 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9201   -1.0540    0.9817 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1134   -1.4339   -0.5383 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.9820   -2.8260   -0.0831 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.1047   -1.5145    0.2112 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8870   -2.5171   -2.4443 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5211   -2.7753   -1.8646 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5668   -1.2103   -3.6826 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3967   -0.1406   -2.9226 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.6450    0.6952   -2.7804 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.9427    0.3926   -1.0993 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3070   -1.8568   -1.2072 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8674   -1.2964   -2.7962 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.9584    0.6625   -1.8115 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5185   -0.8392   -1.0193 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3369    0.2524    0.5501 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.8040    2.3189    2.5772 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.0408    1.1123    2.3283 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.7027    2.1184    3.6965 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