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
-7.1061 -2.3428 1.3624 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.3989 -0.8870 1.6995 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.3677 -0.0669 0.8940 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.5595 1.3915 1.1473 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.6781 2.3162 0.4311 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2317 2.3382 0.6022 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.3981 1.1533 0.2482 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5435 0.7666 -1.1917 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8538 -0.4333 -1.6481 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4123 -0.6348 -1.5841 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7030 -0.7106 -0.2935 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7960 -0.9432 -0.4664 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4745 0.1319 -1.2383 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9756 -0.2948 -1.2951 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7596 0.7051 -2.0445 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1722 0.4832 -2.3262 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1948 0.2819 -1.2827 C 0 0 0 0 0 0 0 0 0 0 0 0
6.1585 -0.9233 -0.4338 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2517 -0.9657 0.5362 N 0 0 0 0 0 0 0 0 0 0 0 0
7.4289 0.0107 1.5463 C 0 0 0 0 0 0 0 0 0 0 0 0
6.5878 0.9540 1.5988 O 0 0 0 0 0 0 0 0 0 0 0 0
8.5387 -0.0578 2.4989 C 0 0 0 0 0 0 0 0 0 0 0 0
9.4490 -0.9967 2.5132 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.1602 -2.6122 1.8636 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.9206 -3.0126 1.6917 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.9368 -2.4733 0.2681 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.1550 -0.7459 2.7671 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.4211 -0.6058 1.4227 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.5466 -0.3455 -0.1723 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.4092 -0.4946 1.1790 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.6271 1.6051 0.7928 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.6462 1.6121 2.2472 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.9064 2.2375 -0.6957 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.0305 3.4009 0.6063 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9764 2.7165 1.6444 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8260 3.1904 -0.0436 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3732 0.3080 0.8978 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3164 1.6048 0.3831 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.6603 0.5723 -1.3249 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3975 1.6607 -1.8674 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1593 -0.6901 -2.7360 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3343 -1.3381 -1.1105 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2008 -1.6035 -2.1640 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9087 0.1179 -2.2938 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0428 -1.6603 0.2348 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8043 0.0666 0.4356 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2165 -0.9339 0.5641 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9663 -1.9438 -0.8694 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4810 1.0965 -0.6932 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1105 0.3172 -2.2496 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0793 -1.3255 -1.6081 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3284 -0.2323 -0.2157 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6445 1.7267 -1.5570 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2256 0.8578 -3.0416 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5941 1.3440 -2.9819 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3047 -0.4042 -3.0444 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3090 1.2100 -0.6340 H 0 0 0 0 0 0 0 0 0 0 0 0
7.1957 0.2465 -1.8489 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2120 -1.1331 0.0333 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3536 -1.8051 -1.1315 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9380 -1.7635 0.4772 H 0 0 0 0 0 0 0 0 0 0 0 0
8.6018 0.7377 3.2478 H 0 0 0 0 0 0 0 0 0 0 0 0
9.4311 -1.8005 1.7983 H 0 0 0 0 0 0 0 0 0 0 0 0
10.2335 -0.9811 3.2423 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