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
-8.5068 -0.7458 -2.3506 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.2043 -0.3448 -1.7308 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.3291 -0.0019 -0.2713 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.8843 0.3829 0.1777 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.8841 0.7435 1.6143 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6304 1.1841 2.2102 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4293 0.3697 2.3295 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7467 -0.1641 1.1328 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4796 -0.9052 1.5717 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5123 -0.0391 2.2972 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0257 1.1325 1.4885 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6769 0.7515 0.2257 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8926 -0.0891 0.4456 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5072 -0.4022 -0.9040 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7512 -1.2573 -0.7458 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8014 -0.5630 0.0851 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2423 0.7382 -0.5187 C 0 0 0 0 0 0 0 0 0 0 0 0
5.8364 0.5796 -1.8846 C 0 0 0 0 0 0 0 0 0 0 0 0
6.9961 -0.2854 -1.8609 N 0 0 0 0 0 0 0 0 0 0 0 0
8.1458 0.0271 -1.1062 C 0 0 0 0 0 0 0 0 0 0 0 0
8.1236 1.1095 -0.4453 O 0 0 0 0 0 0 0 0 0 0 0 0
9.3108 -0.8450 -1.0793 C 0 0 0 0 0 0 0 0 0 0 0 0
9.3760 -1.9715 -1.7466 C 0 0 0 0 0 0 0 0 0 0 0 0
-9.1096 -1.3990 -1.6877 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.2847 -1.2484 -3.3171 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.0764 0.1738 -2.5913 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.8434 0.5586 -2.2842 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.4410 -1.1177 -1.8749 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.0039 0.8401 -0.0775 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.5643 -0.9230 0.2934 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.6267 1.2226 -0.4984 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.3293 -0.5412 -0.0283 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.4292 -0.0359 2.2335 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.6111 1.6266 1.7012 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.8932 1.5187 3.2892 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3574 2.1842 1.7266 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5734 -0.4536 3.0924 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6541 1.0308 2.8611 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3667 -1.0178 0.7189 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5237 0.5957 0.3875 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7884 -1.7259 2.2277 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0052 -1.3212 0.6845 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8135 0.2935 3.2943 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4000 -0.6827 2.4747 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8171 1.8622 1.3164 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7391 1.6564 2.1347 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9921 1.6812 -0.2794 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0276 0.2467 -0.4780 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6211 -1.0669 0.8918 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6197 0.4801 1.0313 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7140 0.4970 -1.5048 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7836 -1.0265 -1.4956 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4855 -2.2469 -0.3464 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1593 -1.4296 -1.7610 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6919 -1.2357 0.0933 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5060 -0.4163 1.1236 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3250 1.3765 -0.6157 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9268 1.2249 0.1786 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0897 0.1678 -2.6038 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0956 1.5908 -2.2884 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9536 -1.1718 -2.4352 H 0 0 0 0 0 0 0 0 0 0 0 0
10.1558 -0.5314 -0.4726 H 0 0 0 0 0 0 0 0 0 0 0 0
10.2675 -2.5855 -1.6929 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5859 -2.3324 -2.3559 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