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
-8.6697 2.3838 -1.8687 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.3658 1.8416 -0.4709 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.1839 0.9096 -0.6262 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.7782 0.2994 0.7001 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.5976 -0.6066 0.4256 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.0957 -1.2800 1.6800 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9240 -2.1550 1.2928 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7973 -1.3457 0.6696 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2778 -0.2993 1.6249 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1847 0.4760 0.9470 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0245 -0.3843 0.5317 C 0 0 0 0 0 0 0 0 0 0 0 0
1.0215 0.5015 -0.1226 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2256 -0.2852 -0.5820 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9185 -0.9892 0.5409 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1236 -1.7895 0.1229 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1348 -0.8675 -0.5031 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3782 -1.6409 -0.9235 C 0 0 0 0 0 0 0 0 0 0 0 0
7.3430 -0.6711 -1.5420 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7222 0.3329 -0.5733 N 0 0 0 0 0 0 0 0 0 0 0 0
8.6263 1.3860 -0.9115 C 0 0 0 0 0 0 0 0 0 0 0 0
9.0506 1.3551 -2.1074 O 0 0 0 0 0 0 0 0 0 0 0 0
9.0453 2.4191 0.0081 C 0 0 0 0 0 0 0 0 0 0 0 0
8.6219 2.4711 1.2428 C 0 0 0 0 0 0 0 0 0 0 0 0
-9.2447 3.3160 -1.7566 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.7380 2.5811 -2.4301 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.2140 1.5981 -2.4193 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.0549 2.6563 0.2085 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.2434 1.3099 -0.0695 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.3118 1.4965 -0.9801 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.3595 0.0961 -1.3389 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.5608 1.0932 1.4223 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.6345 -0.3454 1.0537 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.8178 0.0165 -0.0478 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.9502 -1.4105 -0.2507 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.9199 -1.9532 2.0407 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.8043 -0.5613 2.4664 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4800 -2.6729 2.1702 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2817 -2.8565 0.5195 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9660 -2.1043 0.5455 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0292 -0.9709 -0.3291 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0920 0.4025 1.9474 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8886 -0.8577 2.5232 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7620 1.2743 1.6125 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6168 1.0375 0.0796 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4242 -0.8632 1.4208 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3828 -1.1605 -0.1759 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3545 1.2665 0.5972 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6113 1.0318 -0.9953 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8313 -1.0247 -1.3324 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9037 0.3649 -1.1591 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2134 -1.6954 1.0563 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1943 -0.2474 1.3179 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8247 -2.5855 -0.6184 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5543 -2.2955 1.0203 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4069 -0.0854 0.1969 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7025 -0.4150 -1.4401 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8585 -2.0231 0.0102 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1398 -2.4841 -1.5812 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8523 -0.1748 -2.4150 H 0 0 0 0 0 0 0 0 0 0 0 0
8.2215 -1.2647 -1.8846 H 0 0 0 0 0 0 0 0 0 0 0 0
7.3454 0.2910 0.3761 H 0 0 0 0 0 0 0 0 0 0 0 0
9.7282 3.1743 -0.3268 H 0 0 0 0 0 0 0 0 0 0 0 0
8.9335 3.2456 1.9391 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9401 1.7384 1.6191 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