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
7.8632 -1.2841 -0.5660 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6331 -0.0073 -0.5256 C 0 0 0 0 0 0 0 0 0 0 0 0
7.8812 1.2618 -0.4268 C 0 0 0 0 0 0 0 0 0 0 0 0
6.9234 1.6092 -1.4948 C 0 0 0 0 0 0 0 0 0 0 0 0
5.7255 0.7541 -1.6802 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8506 0.7997 -0.4615 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6194 -0.0751 -0.5950 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7602 -0.0108 0.6412 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5564 -0.8803 0.5217 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6552 -0.5292 -0.6068 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5474 -1.4114 -0.6969 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3583 -1.2994 0.5764 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5874 -2.1810 0.5028 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3479 -2.0502 1.7948 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7694 -0.6274 2.0241 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6582 -0.1018 0.9049 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.0086 1.3286 1.2688 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.8797 1.8924 0.1989 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.1050 1.0825 0.1226 N 0 0 0 0 0 0 0 0 0 0 0 0
-8.1121 1.4000 -0.8251 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.8981 2.3977 -1.5827 O 0 0 0 0 0 0 0 0 0 0 0 0
-9.3202 0.6176 -0.9148 C 0 0 0 0 0 0 0 0 0 0 0 0
-9.6139 -0.4208 -0.1730 C 0 0 0 0 0 0 0 0 0 0 0 0
8.4068 -2.1077 -0.0156 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8864 -1.1550 -0.0911 H 0 0 0 0 0 0 0 0 0 0 0 0
7.7791 -1.5795 -1.6552 H 0 0 0 0 0 0 0 0 0 0 0 0
9.4263 0.0275 -1.3256 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2581 -0.0694 0.4289 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4407 1.3287 0.6028 H 0 0 0 0 0 0 0 0 0 0 0 0
8.6634 2.0893 -0.4183 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5520 2.6608 -1.2977 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4921 1.7228 -2.4522 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8902 -0.2518 -2.0708 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1061 1.2641 -2.4912 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4230 0.5683 0.4417 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5077 1.8549 -0.3412 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8921 -1.1355 -0.7647 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9973 0.2412 -1.4572 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4905 1.0396 0.8986 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4243 -0.3358 1.4912 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0530 -0.8683 1.5115 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8670 -1.9540 0.3654 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2378 -0.6739 -1.5640 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3715 0.5485 -0.6232 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2046 -0.9813 -1.5087 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3343 -2.4371 -0.9970 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7407 -0.2358 0.5778 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8236 -1.5836 1.4788 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3065 -3.2540 0.3769 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2126 -1.9448 -0.3763 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7018 -2.3210 2.6720 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2023 -2.7586 1.8537 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8856 0.0131 2.1813 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3307 -0.5545 3.0096 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.5323 -0.7546 0.7684 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0657 -0.1454 -0.0374 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.6454 1.2475 2.1980 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1341 1.9272 1.5131 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.3739 1.9553 -0.7820 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.1366 2.9454 0.4941 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.2606 0.2734 0.7543 H 0 0 0 0 0 0 0 0 0 0 0 0
-10.0505 0.9187 -1.6658 H 0 0 0 0 0 0 0 0 0 0 0 0
-10.5400 -0.9793 -0.2789 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.9456 -0.7795 0.5891 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