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
-7.9193 -0.9620 2.2255 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.3423 0.4761 2.0906 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.3022 0.9733 0.6851 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.9311 0.9028 0.0592 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.9048 1.6962 0.7728 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5803 1.5901 0.0761 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1434 0.1460 0.0536 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7878 0.1222 -0.6452 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3144 -1.2997 -0.6897 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9865 -1.4251 -1.3628 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0290 -0.6095 -0.6050 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3739 -0.7622 -1.3176 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3792 0.0489 -0.5622 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7279 -0.0270 -1.1910 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2196 -1.4434 -1.2173 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5838 -1.5736 -1.8299 C 0 0 0 0 0 0 0 0 0 0 0 0
6.5928 -0.7596 -1.0725 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6550 -1.2497 0.3511 C 0 0 0 0 0 0 0 0 0 0 0 0
7.6446 -0.4691 1.0587 N 0 0 0 0 0 0 0 0 0 0 0 0
7.5879 0.9320 1.2522 C 0 0 0 0 0 0 0 0 0 0 0 0
6.6029 1.5667 0.7808 O 0 0 0 0 0 0 0 0 0 0 0 0
8.6129 1.6708 1.9691 C 0 0 0 0 0 0 0 0 0 0 0 0
8.5046 2.9639 2.1151 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.4468 -1.4016 3.0955 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.2620 -1.5133 1.3256 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.8233 -1.0921 2.2733 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.7872 1.1425 2.8022 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.4052 0.5280 2.4274 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.0364 0.3917 0.0925 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.6216 2.0350 0.6741 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.6747 -0.1850 0.0521 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.9700 1.2221 -0.9997 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.7309 1.3751 1.8224 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.1717 2.7941 0.7782 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8062 2.2128 0.5935 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.7256 1.9352 -0.9767 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.8272 -0.5096 -0.5278 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0097 -0.2780 1.0527 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1292 0.7581 -0.0125 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8795 0.5967 -1.6309 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1734 -1.6241 0.3762 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0704 -1.9322 -1.1855 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0170 -1.0924 -2.4248 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7132 -2.4941 -1.3855 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0838 -0.9506 0.4472 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2091 0.4664 -0.6086 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2612 -0.3315 -2.3245 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6266 -1.8238 -1.3937 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4023 -0.2650 0.5033 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0928 1.1293 -0.5333 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4126 0.6255 -0.6125 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6739 0.4105 -2.2123 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5472 -2.1006 -1.8319 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2221 -1.8576 -0.1952 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5741 -1.2382 -2.8899 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8852 -2.6387 -1.7362 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5942 -0.9829 -1.5312 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3899 0.3236 -1.1261 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6832 -1.0628 0.8898 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8942 -2.3179 0.4166 H 0 0 0 0 0 0 0 0 0 0 0 0
8.4692 -0.9623 1.4629 H 0 0 0 0 0 0 0 0 0 0 0 0
9.4565 1.1537 2.3771 H 0 0 0 0 0 0 0 0 0 0 0 0
9.2641 3.5204 2.6477 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6549 3.5253 1.7107 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