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
7.2290 2.4691 -2.5890 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0577 1.0438 -2.1096 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6924 1.0981 -0.6320 C 0 0 0 0 0 0 0 0 0 0 0 0
6.5019 -0.2941 -0.0707 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1423 -0.2232 1.3954 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8749 0.5367 1.6382 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6812 -0.0771 0.9394 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4023 -1.4710 1.3686 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2269 -2.0178 0.6166 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9733 -1.2147 0.8554 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.1175 -1.9113 0.0502 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4653 -1.2004 0.1892 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9312 -1.1585 1.5929 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2041 -0.4533 1.7973 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4635 -0.8956 1.2119 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6779 -0.9861 -0.2381 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4658 0.2881 -0.9981 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.3420 1.4189 -0.5973 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.7330 1.0883 -0.8076 N 0 0 0 0 0 0 0 0 0 0 0 0
-7.7307 2.0555 -0.4684 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.2989 3.1600 0.0046 O 0 0 0 0 0 0 0 0 0 0 0 0
-9.1597 1.8354 -0.6358 C 0 0 0 0 0 0 0 0 0 0 0 0
-9.6632 0.7208 -1.1167 C 0 0 0 0 0 0 0 0 0 0 0 0
7.5451 3.0882 -1.7170 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9586 2.5392 -3.4242 H 0 0 0 0 0 0 0 0 0 0 0 0
6.2287 2.8400 -2.8979 H 0 0 0 0 0 0 0 0 0 0 0 0
6.2409 0.5925 -2.7135 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0202 0.5088 -2.2588 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7363 1.6593 -0.5893 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5170 1.6129 -0.1192 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4359 -0.8839 -0.1657 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7287 -0.7875 -0.6850 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9756 0.3688 1.8774 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1630 -1.2027 1.8694 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9533 1.5834 1.2854 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6404 0.5742 2.7188 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7803 0.5552 1.1952 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7637 -0.0452 -0.1633 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2561 -2.1693 1.1501 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2037 -1.5296 2.4788 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4938 -1.9632 -0.4803 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0645 -3.1024 0.7992 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7445 -1.1638 1.9249 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1049 -0.1653 0.4924 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1573 -2.9483 0.3839 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1883 -1.8557 -1.0117 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1485 -1.7964 -0.4339 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2941 -0.1747 -0.1703 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0106 -2.1930 2.0375 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1722 -0.6311 2.2673 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9995 0.6534 1.6226 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3733 -0.4618 2.9404 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.3367 -0.3269 1.6806 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.6587 -1.9531 1.6172 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.8316 -1.1475 -0.3392 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2972 -1.8358 -0.7922 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3863 0.5717 -1.0645 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.7322 0.0463 -2.0719 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.0668 2.3044 -1.1984 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.2127 1.6726 0.4786 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.0404 0.1754 -1.2019 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.8118 2.6558 -0.3375 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.0170 -0.0785 -1.4067 H 0 0 0 0 0 0 0 0 0 0 0 0
-10.7255 0.6019 -1.2230 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