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
5.3975 1.1142 -3.3513 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6697 0.5300 -2.8510 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0206 0.7880 -1.4361 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1142 0.2874 -0.3831 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7117 0.7800 -0.3772 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0399 0.1064 0.8456 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6245 0.6027 0.8518 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8937 0.0047 2.0271 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8959 -1.4914 1.9099 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1634 -2.1168 3.0506 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2879 -1.7164 3.1288 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0168 -2.1396 1.8738 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4768 -1.7730 1.9184 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7331 -0.2930 2.0406 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1747 0.4792 0.8687 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7850 0.0451 -0.4408 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2852 0.2393 -0.4760 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.7428 -0.2427 -1.8532 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.1501 -0.1211 -2.0386 N 0 0 0 0 0 0 0 0 0 0 0 0
-6.8659 1.1044 -1.9733 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.2274 2.1431 -1.7391 O 0 0 0 0 0 0 0 0 0 0 0 0
-8.3023 1.1406 -2.1746 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.9368 2.2798 -2.1095 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6527 0.2858 -3.5022 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9860 1.9510 -2.7861 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5860 1.5440 -4.3907 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7119 -0.5886 -2.9976 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5314 0.8876 -3.4936 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0324 0.3097 -1.2392 H 0 0 0 0 0 0 0 0 0 0 0 0
7.2147 1.8876 -1.2594 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5634 0.5686 0.6090 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1291 -0.8357 -0.3939 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0830 0.4468 -1.2272 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6065 1.8595 -0.2297 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6364 0.4176 1.7132 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1233 -0.9717 0.6359 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5619 1.7066 0.8340 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1688 0.2706 -0.1206 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3873 0.3024 2.9893 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8953 0.4439 2.0548 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5146 -1.7640 0.9193 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9451 -1.9060 1.9486 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2530 -3.2216 3.0336 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6520 -1.7401 3.9941 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3277 -0.6198 3.2788 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7331 -2.1628 4.0404 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9693 -3.2417 1.7714 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5162 -1.6427 1.0181 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0214 -2.1165 1.0157 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9999 -2.2602 2.7765 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8049 -0.1325 2.1356 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2489 0.0522 2.9611 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0823 0.3468 0.7565 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3581 1.5574 1.0399 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5199 -1.0015 -0.6474 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3598 0.6898 -1.2372 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.7371 -0.4230 0.2998 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5120 1.2987 -0.3221 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1430 0.3187 -2.5972 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.4540 -1.3108 -1.9101 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.7323 -0.9719 -2.2390 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.8483 0.2364 -2.3771 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.4125 3.1910 -1.9093 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.9998 2.3122 -2.2577 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