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
-9.9429 0.0886 -0.2810 C 0 0 0 0 0 0 0 0 0 0 0 0
-9.2789 0.9400 0.7842 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.0176 0.2645 1.3096 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.0949 0.0902 0.1426 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.7896 -0.5703 0.4949 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.0676 0.2702 1.5195 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7527 -0.2969 1.9418 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8246 -0.4239 0.7369 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5123 -0.9913 1.1712 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5810 -1.1392 -0.0021 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3402 0.1917 -0.6247 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5971 0.1336 -1.8057 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9636 -0.4061 -1.4784 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6079 0.4632 -0.4538 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9852 0.0389 -0.0304 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8954 0.0380 -1.2107 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3131 -0.3691 -0.9072 C 0 0 0 0 0 0 0 0 0 0 0 0
6.9240 0.5600 0.0877 C 0 0 0 0 0 0 0 0 0 0 0 0
8.2717 0.2472 0.4298 N 0 0 0 0 0 0 0 0 0 0 0 0
9.3453 0.2076 -0.5055 C 0 0 0 0 0 0 0 0 0 0 0 0
9.0626 0.4667 -1.6922 O 0 0 0 0 0 0 0 0 0 0 0 0
10.6984 -0.1104 -0.1398 C 0 0 0 0 0 0 0 0 0 0 0 0
11.6479 -0.1307 -1.0520 C 0 0 0 0 0 0 0 0 0 0 0 0
-9.7235 -0.9721 -0.0572 H 0 0 0 0 0 0 0 0 0 0 0 0
-11.0193 0.2866 -0.2440 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.5408 0.3240 -1.2912 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.9852 1.8979 0.3092 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.9944 1.0605 1.6106 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.6110 0.9694 2.0794 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.2719 -0.7141 1.7586 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.8802 1.1218 -0.2538 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.6271 -0.5063 -0.6200 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.2282 -0.7118 -0.4382 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.0299 -1.5760 0.8902 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.7293 0.2726 2.4330 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.9400 1.3005 1.1742 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2704 0.4414 2.6143 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8326 -1.2392 2.5036 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2642 -1.0628 -0.0290 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6818 0.6443 0.4018 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0276 -0.3538 1.9653 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6667 -1.9782 1.6764 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0532 -1.8623 -0.7000 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3675 -1.5730 0.3991 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0462 0.9186 0.1476 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3296 0.5214 -1.0711 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7228 1.1973 -2.1470 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1317 -0.4090 -2.6532 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9228 -1.4724 -1.1653 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5175 -0.3990 -2.4637 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6754 1.4932 -0.8841 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9115 0.5514 0.4057 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8900 -0.9791 0.4100 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2984 0.7684 0.7596 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4467 -0.6726 -1.9636 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8404 1.0484 -1.6814 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8705 -0.3240 -1.8690 H 0 0 0 0 0 0 0 0 0 0 0 0
6.2648 -1.4152 -0.5149 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3020 0.6022 1.0037 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9202 1.5829 -0.3499 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5041 0.0315 1.4198 H 0 0 0 0 0 0 0 0 0 0 0 0
10.9527 -0.3362 0.8862 H 0 0 0 0 0 0 0 0 0 0 0 0
11.4199 0.0924 -2.0903 H 0 0 0 0 0 0 0 0 0 0 0 0
12.6840 -0.3699 -0.7964 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