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
-8.8662 1.2091 1.1127 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.8569 -0.2463 1.5319 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.3749 -1.0688 0.3891 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.9982 -0.6506 -0.0147 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.0495 -0.8347 1.1316 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6653 -0.4058 0.6569 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6943 -0.5759 1.7735 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2892 -0.1538 1.3502 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7822 -0.9589 0.2040 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3962 -0.5417 -0.1731 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3283 0.8836 -0.5883 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0479 1.3664 -0.9749 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5629 0.5849 -2.1219 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9243 1.0059 -2.6015 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9966 0.8910 -1.5629 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2942 1.3475 -2.1943 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4579 1.2851 -1.2536 C 0 0 0 0 0 0 0 0 0 0 0 0
6.7428 -0.0918 -0.7250 C 0 0 0 0 0 0 0 0 0 0 0 0
7.9012 0.0094 0.1713 N 0 0 0 0 0 0 0 0 0 0 0 0
8.3736 -1.1660 0.8042 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7612 -2.2504 0.5570 O 0 0 0 0 0 0 0 0 0 0 0 0
9.5096 -1.1952 1.7115 C 0 0 0 0 0 0 0 0 0 0 0 0
10.1931 -0.1194 2.0169 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.8263 1.2841 -0.0007 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.9652 1.7143 1.5019 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.7816 1.7350 1.4282 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.9363 -0.5029 1.7079 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.2955 -0.3399 2.4553 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.0799 -0.9039 -0.4696 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.3792 -2.1555 0.6432 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.9437 0.4091 -0.3381 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.7003 -1.2559 -0.9102 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.0224 -1.9247 1.3792 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.3602 -0.2478 2.0044 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.4478 -0.9999 -0.2323 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.6990 0.6684 0.3882 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0359 0.0311 2.6360 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6641 -1.6330 2.1452 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6016 -0.3038 2.2060 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4095 0.9327 1.0885 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4762 -0.9834 -0.6645 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6966 -2.0199 0.5769 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2472 -0.7068 0.7186 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0563 -1.1814 -1.0343 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0468 0.9972 -1.4586 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7752 1.5562 0.1895 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9500 2.4536 -1.1721 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6962 1.1803 -0.0732 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6036 -0.5019 -1.8159 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8377 0.6349 -2.9549 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8766 2.0382 -2.9998 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2009 0.3480 -3.4500 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1453 -0.1574 -1.2329 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8222 1.4933 -0.6642 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4553 0.7432 -3.1120 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1716 2.3955 -2.5402 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3478 1.9867 -0.4208 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3638 1.5744 -1.8633 H 0 0 0 0 0 0 0 0 0 0 0 0
7.0155 -0.8107 -1.4973 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8451 -0.4287 -0.1598 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3702 0.9234 0.3423 H 0 0 0 0 0 0 0 0 0 0 0 0
9.8154 -2.1280 2.1589 H 0 0 0 0 0 0 0 0 0 0 0 0
9.9368 0.8344 1.6040 H 0 0 0 0 0 0 0 0 0 0 0 0
11.0346 -0.1435 2.6894 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