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
-6.1297 3.2417 -1.2891 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.2025 2.2864 -1.7089 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.3424 1.2161 -0.6506 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.9741 0.5163 -0.5586 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.0266 -0.5630 0.4722 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6720 -1.2692 0.5528 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6278 -0.2761 0.9327 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2648 -1.0050 1.0874 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8697 -1.6152 -0.1740 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6746 -2.4545 -0.3391 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6441 -1.8612 0.0284 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8481 -1.7257 1.4668 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1060 -1.2504 2.0600 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6216 0.0668 1.6867 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1216 0.2046 0.3025 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2761 -0.7965 0.1436 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9169 -0.7705 -1.1789 C 0 0 0 0 0 0 0 0 0 0 0 0
5.6091 0.4124 -1.6918 C 0 0 0 0 0 0 0 0 0 0 0 0
6.7818 0.9064 -1.0794 N 0 0 0 0 0 0 0 0 0 0 0 0
6.9072 1.4295 0.2137 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9355 1.5290 0.9993 O 0 0 0 0 0 0 0 0 0 0 0 0
8.1856 1.8884 0.7153 C 0 0 0 0 0 0 0 0 0 0 0 0
9.2700 1.8452 0.0161 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.0103 3.2739 -0.1821 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.1698 2.9729 -1.7592 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.3776 4.2941 -1.5976 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.2070 2.7612 -1.8089 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.9474 1.7437 -2.6603 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.0573 0.4167 -0.9454 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.5794 1.6487 0.3328 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.7705 0.1017 -1.5661 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.2720 1.3384 -0.2741 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.1812 -0.0816 1.4744 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.8000 -1.3123 0.2504 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.7090 -2.1552 1.1867 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5106 -1.6343 -0.4934 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8300 0.1896 1.9159 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5093 0.5172 0.1510 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5629 -0.1351 1.3525 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3788 -1.6549 1.9632 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7496 -2.2297 -0.6097 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8691 -0.7565 -0.9508 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7831 -3.4179 0.2540 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5730 -2.7567 -1.4342 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5405 -0.8085 -0.4704 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4903 -2.2939 -0.5419 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7880 -2.8495 1.8753 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0393 -1.3022 1.9868 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9841 -1.2049 3.2172 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9285 -2.0376 2.0019 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4862 0.3811 2.3848 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8249 0.8614 1.9172 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4697 1.2552 0.0793 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4285 -0.0292 -0.4767 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7054 -1.8045 0.1661 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9068 -0.8521 1.0170 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1616 -1.0989 -1.9578 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6456 -1.6630 -1.1797 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8164 1.2555 -1.7238 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7725 0.2600 -2.8011 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6817 0.8672 -1.6991 H 0 0 0 0 0 0 0 0 0 0 0 0
8.2476 2.2938 1.7358 H 0 0 0 0 0 0 0 0 0 0 0 0
9.3598 1.4802 -0.9817 H 0 0 0 0 0 0 0 0 0 0 0 0
10.2098 2.2102 0.4565 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