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
-7.7035 0.7166 2.6484 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.2502 -0.4533 1.9041 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.0325 -0.5129 0.4474 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.6360 -0.6118 -0.0476 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.7908 0.5375 0.3576 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3767 0.3581 -0.2624 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5978 1.5539 0.1954 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1678 1.5507 -0.3226 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5075 0.3190 0.1894 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0729 0.2063 -0.2451 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0163 0.1680 -1.7504 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4142 0.0382 -2.2465 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0656 -1.2265 -1.7366 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4677 -1.3067 -2.2535 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3183 -0.1113 -1.8057 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4034 -0.0353 -0.3043 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2313 1.1529 0.0931 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6264 1.0148 -0.4706 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2090 -0.1976 0.0383 N 0 0 0 0 0 0 0 0 0 0 0 0
7.4334 -0.4872 1.4133 C 0 0 0 0 0 0 0 0 0 0 0 0
7.0889 0.4049 2.2468 O 0 0 0 0 0 0 0 0 0 0 0 0
8.0283 -1.7411 1.8588 C 0 0 0 0 0 0 0 0 0 0 0 0
8.2063 -1.9423 3.1378 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.8921 0.3597 3.3401 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.4538 1.5982 2.0607 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.4809 1.1159 3.3976 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.3714 -0.4360 2.0732 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.9186 -1.4344 2.3743 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.4996 0.3575 -0.0944 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.5686 -1.4271 0.0218 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.2095 -1.5902 0.3450 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.6331 -0.7793 -1.1575 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.1320 1.5240 0.0767 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.5674 0.4121 1.4513 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0251 -0.6002 0.1401 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.4351 0.3739 -1.3614 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0746 2.4567 -0.1925 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5439 1.6136 1.2954 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1694 1.6183 -1.4425 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6885 2.4733 0.0554 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6211 0.2925 1.2932 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0330 -0.5636 -0.2835 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2973 -0.7726 0.1786 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5641 1.0096 0.1798 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6843 -0.6166 -2.1265 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3626 1.1621 -2.1372 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9506 0.9312 -1.8407 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3850 -0.0009 -3.3344 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0795 -1.3202 -0.6438 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5036 -2.0751 -2.2184 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9973 -2.2096 -1.9244 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4639 -1.2774 -3.3567 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3174 -0.2899 -2.2617 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9532 0.8390 -2.2018 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3980 -0.0220 0.1684 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9145 -0.9304 0.1289 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2421 1.3072 1.1904 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7247 2.0687 -0.3179 H 0 0 0 0 0 0 0 0 0 0 0 0
7.2034 1.9187 -0.1282 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6588 0.9925 -1.5707 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5023 -0.9490 -0.6393 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3069 -2.4725 1.1158 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9184 -1.1953 3.8476 H 0 0 0 0 0 0 0 0 0 0 0 0
8.6423 -2.8574 3.4906 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