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
10.0246 -2.3118 -0.4810 C 0 0 0 0 0 0 0 0 0 0 0 0
8.8024 -1.8442 -1.2083 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7600 -1.2714 -0.2491 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6055 -0.8469 -1.0930 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4565 -0.2354 -0.2783 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9222 -1.1897 0.7055 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8388 -0.7212 1.5708 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4961 -0.3789 1.0790 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3753 0.6842 0.0683 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9049 1.0103 -0.2547 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1373 1.4932 0.9278 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2942 1.7749 0.4104 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1326 2.2635 1.5310 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5217 2.5850 1.2095 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5030 1.5641 0.8135 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3047 0.7118 -0.3639 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.5340 -0.1965 -0.5394 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.7962 0.5748 -0.7455 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.8767 -0.4073 -0.9396 N 0 0 0 0 0 0 0 0 0 0 0 0
-9.1762 0.0880 -1.1551 C 0 0 0 0 0 0 0 0 0 0 0 0
-9.3583 1.3537 -1.1725 O 0 0 0 0 0 0 0 0 0 0 0 0
-10.2871 -0.8134 -1.3535 C 0 0 0 0 0 0 0 0 0 0 0 0
-10.1869 -2.1212 -1.3504 C 0 0 0 0 0 0 0 0 0 0 0 0
10.8321 -1.5503 -0.6884 H 0 0 0 0 0 0 0 0 0 0 0 0
9.8730 -2.3927 0.6146 H 0 0 0 0 0 0 0 0 0 0 0 0
10.3805 -3.2447 -0.9466 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3140 -2.7237 -1.6838 H 0 0 0 0 0 0 0 0 0 0 0 0
9.0091 -1.1295 -2.0264 H 0 0 0 0 0 0 0 0 0 0 0 0
8.1825 -0.4493 0.3372 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4993 -2.1326 0.4319 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9443 -0.0915 -1.8023 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1831 -1.7174 -1.6188 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7716 0.1383 -1.0330 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8240 0.6597 0.2783 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6290 -2.1828 0.2151 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8142 -1.5106 1.3567 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6676 -1.5717 2.3484 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2588 0.1521 2.2142 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0619 -1.3672 0.6675 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8023 -0.1879 1.9633 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6998 0.2242 -0.9259 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8645 1.6105 0.3133 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9560 1.8057 -1.0256 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4848 0.0856 -0.7008 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0982 0.8211 1.7856 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5231 2.4767 1.2626 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6456 0.9772 -0.2005 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1385 2.6754 -0.2750 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1267 1.4438 2.3369 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6002 3.0979 2.0725 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5671 3.3864 0.3898 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0251 3.1617 2.0754 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.4660 2.1607 0.6076 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.7423 0.9025 1.7155 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4831 -0.0510 -0.2390 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1759 1.2638 -1.2930 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.3572 -0.8641 -1.4014 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.6472 -0.8062 0.3845 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.7761 1.2195 -1.6303 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.0245 1.1305 0.2017 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.6624 -1.3990 -0.9138 H 0 0 0 0 0 0 0 0 0 0 0 0
-11.3021 -0.4165 -1.5217 H 0 0 0 0 0 0 0 0 0 0 0 0
-11.0367 -2.7716 -1.5017 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.2491 -2.5983 -1.1961 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