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
-8.6381 0.0803 0.8396 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.5950 0.2279 1.9238 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.3319 -0.5300 1.5900 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.6940 -0.0561 0.3088 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.3110 1.3899 0.3527 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6850 1.7958 -0.9489 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4297 1.0025 -1.2749 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3990 1.1894 -0.2180 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0978 0.4144 -0.4991 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3412 -1.0355 -0.5847 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2647 -1.9827 -0.8915 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9132 -2.1762 -0.0480 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8138 -1.0192 0.1066 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3187 -0.5812 -1.2578 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2370 0.5859 -1.1431 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4652 0.2680 -0.2664 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2427 -0.8506 -0.8352 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4235 -1.3012 -0.1036 C 0 0 0 0 0 0 0 0 0 0 0 0
7.4619 -0.3659 0.1216 N 0 0 0 0 0 0 0 0 0 0 0 0
7.4294 0.7300 1.0001 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4100 0.9713 1.7395 O 0 0 0 0 0 0 0 0 0 0 0 0
8.5641 1.6608 1.1190 C 0 0 0 0 0 0 0 0 0 0 0 0
9.6430 1.5093 0.4168 C 0 0 0 0 0 0 0 0 0 0 0 0
-9.2096 -0.8807 0.9730 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.2142 0.1362 -0.1808 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.3902 0.8930 0.9061 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.4160 1.2727 2.2016 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.0222 -0.2680 2.8325 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.6211 -1.5899 1.4347 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.5940 -0.4894 2.3967 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.2622 -0.2866 -0.5915 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.7300 -0.6391 0.2243 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.2060 2.0288 0.4921 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.6384 1.5357 1.2209 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.3964 1.6110 -1.7595 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3959 2.8660 -0.9696 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7613 -0.0216 -1.4578 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0355 1.4137 -2.2239 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1022 2.2449 -0.1638 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7947 0.8060 0.7470 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6535 0.7696 -1.4522 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4394 0.7558 0.3234 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8098 -1.4052 0.4026 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1892 -1.2519 -1.3022 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1480 -1.7792 -1.9559 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7077 -3.0360 -1.0858 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6599 -2.6487 0.9563 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5230 -3.0140 -0.5366 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4666 -0.1488 0.6484 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7273 -1.3491 0.7265 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4425 -0.2499 -1.8924 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7613 -1.4121 -1.8346 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6996 1.4485 -0.7289 H 0 0 0 0 0 0 0 0 0 0 0 0
3.6532 0.7992 -2.1511 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1718 0.0759 0.7529 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0923 1.2022 -0.3565 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5048 -1.7225 -0.9283 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5010 -0.5998 -1.9303 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1391 -1.6918 0.9459 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8138 -2.2515 -0.5832 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3753 -0.5291 -0.4555 H 0 0 0 0 0 0 0 0 0 0 0 0
8.4883 2.4918 1.8136 H 0 0 0 0 0 0 0 0 0 0 0 0
10.4451 2.2647 0.5776 H 0 0 0 0 0 0 0 0 0 0 0 0
9.8411 0.7220 -0.3101 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