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
   -9.7370   -0.0135    1.7443 C   0  0  0  0  0  0  0  0  0  0  0  0
   -8.6465   -0.7871    1.0159 C   0  0  0  0  0  0  0  0  0  0  0  0
   -7.6144    0.2188    0.5771 C   0  0  0  0  0  0  0  0  0  0  0  0
   -6.4672   -0.4298   -0.1654 C   0  0  0  0  0  0  0  0  0  0  0  0
   -5.5047    0.6917   -0.5482 C   0  0  0  0  0  0  0  0  0  0  0  0
   -4.3109    0.1173   -1.3063 C   0  0  0  0  0  0  0  0  0  0  0  0
   -3.4150    1.2819   -1.6452 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.1825    0.8845   -2.4012 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3800   -0.0910   -1.5885 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.9737    0.5319   -0.2955 C   0  0  0  0  0  0  0  0  0  0  0  0
   -0.1490   -0.3890    0.5673 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.1237   -0.8305   -0.1137 C   0  0  0  0  0  0  0  0  0  0  0  0
    1.9496    0.3800   -0.4272 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.2508    0.1079   -1.1042 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.1050   -0.7749   -0.2086 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.4352   -1.0750   -0.8362 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.2428   -1.9592    0.0634 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.5001   -1.3117    1.3963 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.2146   -0.0573    1.1645 N   0  0  0  0  0  0  0  0  0  0  0  0
    8.4833    0.0174    0.5456 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.0332   -1.0639    0.1736 O   0  0  0  0  0  0  0  0  0  0  0  0
    9.1196    1.2994    0.3510 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.5608    2.4091    0.7300 C   0  0  0  0  0  0  0  0  0  0  0  0
   -9.2312    0.5825    2.5330 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.1675    0.7310    1.0325 H   0  0  0  0  0  0  0  0  0  0  0  0
  -10.5345   -0.6633    2.1198 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.2422   -1.5670    1.6848 H   0  0  0  0  0  0  0  0  0  0  0  0
   -9.1339   -1.2896    0.1644 H   0  0  0  0  0  0  0  0  0  0  0  0
   -7.2207    0.7233    1.4836 H   0  0  0  0  0  0  0  0  0  0  0  0
   -8.0964    0.9572   -0.0654 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9080   -1.1407    0.4521 H   0  0  0  0  0  0  0  0  0  0  0  0
   -6.8422   -0.8735   -1.1109 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.9910    1.4296   -1.2155 H   0  0  0  0  0  0  0  0  0  0  0  0
   -5.1171    1.1907    0.3510 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.8556   -0.6206   -0.6404 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.5986   -0.3712   -2.2402 H   0  0  0  0  0  0  0  0  0  0  0  0
   -4.0073    1.9264   -2.3608 H   0  0  0  0  0  0  0  0  0  0  0  0
   -3.1171    1.8909   -0.7750 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.4071    0.5032   -3.4209 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.5476    1.7987   -2.5105 H   0  0  0  0  0  0  0  0  0  0  0  0
   -2.0256   -0.9933   -1.4493 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.5037   -0.3968   -2.1997 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4507    1.4869   -0.4251 H   0  0  0  0  0  0  0  0  0  0  0  0
   -1.8790    0.7739    0.3146 H   0  0  0  0  0  0  0  0  0  0  0  0
   -0.7531   -1.2544    0.9244 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.1734    0.2227    1.4555 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6275   -1.5420    0.5814 H   0  0  0  0  0  0  0  0  0  0  0  0
    0.9008   -1.4324   -1.0259 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.1486    0.9010    0.5394 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.3616    1.0263   -1.1291 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.0316   -0.4142   -2.0778 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7394    1.0866   -1.2880 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.2764   -0.1718    0.7218 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.5351   -1.7030   -0.0100 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.9311   -0.0884   -1.0141 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.3320   -1.5484   -1.8387 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.6350   -2.9017    0.2196 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1842   -2.2758   -0.4307 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.5370   -1.1505    1.9056 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.1049   -1.9791    2.0628 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6942    0.7940    1.5033 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.0868    1.3222   -0.1240 H   0  0  0  0  0  0  0  0  0  0  0  0
    9.0958    3.3483    0.5534 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.5968    2.5253    1.2163 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