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
-7.3931 1.8692 -0.5383 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.3138 0.6079 -1.2856 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.9254 -0.6434 -0.6371 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.6356 -0.9256 -0.0485 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.0488 -0.2185 1.0773 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.6897 1.1940 1.0607 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7946 1.7558 0.0381 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4113 1.2454 -0.0534 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1748 -0.1628 -0.4123 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6762 -0.4766 -0.4923 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0201 -0.2336 0.8157 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4883 -0.5337 0.8017 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6623 -1.9802 0.4472 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1166 -2.3529 0.4555 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8770 -1.5378 -0.5505 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3094 -1.9469 -0.5597 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9372 -1.7480 0.7843 C 0 0 0 0 0 0 0 0 0 0 0 0
5.8589 -0.3183 1.1956 C 0 0 0 0 0 0 0 0 0 0 0 0
6.5623 0.5050 0.2320 N 0 0 0 0 0 0 0 0 0 0 0 0
6.5912 1.9042 0.4499 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9971 2.3712 1.4831 O 0 0 0 0 0 0 0 0 0 0 0 0
7.2752 2.7930 -0.4706 C 0 0 0 0 0 0 0 0 0 0 0 0
7.8880 2.3390 -1.5312 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.5191 2.5546 -0.6819 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.6832 1.7582 0.5303 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.2517 2.4898 -0.9661 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.3363 0.4335 -1.7540 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.6331 0.7680 -2.1782 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.1862 -1.4783 -1.4090 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.7150 -0.9418 0.1687 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.6736 -2.0453 0.2866 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.8818 -1.0414 -0.9153 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3116 -0.8456 1.6774 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.9268 -0.2461 1.8915 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0232 1.3058 2.0508 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.4952 1.9164 1.3735 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6929 2.8679 0.2950 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2834 1.8197 -0.9818 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9395 1.4414 0.9661 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7957 1.8734 -0.7736 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5906 -0.8658 0.3029 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6335 -0.4270 -1.4010 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2127 0.0272 -1.3448 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6582 -1.5802 -0.7293 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5199 -0.8439 1.5930 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0799 0.8279 1.1555 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9605 0.1557 0.0493 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9393 -0.2645 1.7746 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2495 -2.1154 -0.5786 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1469 -2.6393 1.1656 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1976 -3.4496 0.2546 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4808 -2.1824 1.4947 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7767 -0.4586 -0.3386 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4516 -1.6789 -1.5768 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8098 -1.3233 -1.3513 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3403 -3.0255 -0.8528 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4448 -2.3694 1.5552 H 0 0 0 0 0 0 0 0 0 0 0 0
7.0174 -2.1005 0.7730 H 0 0 0 0 0 0 0 0 0 0 0 0
6.3294 -0.1996 2.2077 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8237 0.0677 1.2668 H 0 0 0 0 0 0 0 0 0 0 0 0
7.0163 0.0645 -0.5651 H 0 0 0 0 0 0 0 0 0 0 0 0
7.2518 3.8602 -0.2321 H 0 0 0 0 0 0 0 0 0 0 0 0
8.3781 3.0771 -2.1716 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9481 1.3068 -1.8215 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