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
   -7.9061   -1.8780    1.1024 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.7613   -0.5338    0.4536 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2492    0.4885    1.4395 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.0839    1.8353    0.8631 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.2308    2.0671   -0.3032 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7833    1.7547   -0.2776 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3860    0.3453   -0.1098 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.8718    0.1567   -0.1133 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.2446    0.6155   -1.3798 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7548    0.3868   -1.3235 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1279    1.1378   -0.1947 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.3727    0.9452   -0.1324 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.8021   -0.4701    0.0578 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2941   -0.6307    0.1423 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.9414   -0.1501   -1.1101 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4566   -0.3166   -1.0698 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8402   -1.7642   -0.8940 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.3458   -1.8730   -0.8610 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.9532   -1.1241    0.2112 N   0  0  0  0  0  0  0  0  0  0  0  0
    7.6687   -1.3701    1.5779 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.8360   -2.3001    1.8551 O   0  0  0  0  0  0  0  0  0  0  0  0
    8.2975   -0.5964    2.6363 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1622    0.3731    2.4154 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.9438   -2.1460    1.5846 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7713   -1.9361    1.7934 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0483   -2.6284    0.2724 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.7526   -0.1664    0.1047 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.1006   -0.6228   -0.4096 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4958    0.1542    2.1393 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1765    0.6105    2.1492 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.1162    2.2363    0.6008 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.7216    2.5105    1.6910 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.3673    3.1793   -0.5696 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.6358    1.5792   -1.2461 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3473    2.3839    0.5739 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3290    2.2343   -1.1873 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.8414   -0.1510    0.7379 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.7260   -0.2214   -1.0275 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5583   -0.8481    0.1520 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.5197    0.8420    0.7129 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6207    0.0379   -2.2652 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.3997    1.6966   -1.5729 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.2853    0.6181   -2.3054 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5285   -0.7113   -1.1714 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.3178    2.2130   -0.2707 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5290    0.7421    0.7644 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.7333    1.5306    0.7505 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.8487    1.3691   -1.0429 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4028   -0.8550    1.0348 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3770   -1.1316   -0.7377 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5058   -1.6965    0.3685 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.6264   -0.0486    1.0425 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7819    0.9669   -1.1752 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5033   -0.5735   -2.0284 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8852    0.3390   -0.3104 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.8320    0.0043   -2.0624 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4991   -2.3207   -1.7952 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.4352   -2.2407   -0.0009 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.7201   -1.5107   -1.8281 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.6528   -2.9435   -0.7881 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.6299   -0.3696   -0.0201 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.0352   -0.8365    3.6615 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.5940    0.9113    3.2648 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.4987    0.7009    1.4530 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