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
7.0541 -1.3762 2.6375 C 0 0 0 0 0 0 0 0 0 0 0 0
5.8125 -2.0964 2.2031 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1398 -1.3246 1.0225 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8109 0.0232 1.5274 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0899 1.0016 0.7265 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5622 1.5244 -0.5575 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6628 0.5217 -1.6464 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3128 -0.1355 -1.8640 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2737 0.8587 -2.2473 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9160 0.2282 -2.4951 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4371 -0.4589 -1.2626 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.9020 -1.0843 -1.4907 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9646 -0.0847 -1.8744 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1408 0.9563 -0.7925 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1923 1.9674 -1.1436 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5447 1.3654 -1.3597 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.9877 0.6637 -0.0901 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.3575 0.0421 -0.2778 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.7133 -0.6104 0.9661 N 0 0 0 0 0 0 0 0 0 0 0 0
-6.8510 0.0132 2.2090 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.6565 1.2493 2.2853 O 0 0 0 0 0 0 0 0 0 0 0 0
-7.2157 -0.7143 3.4424 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.4365 -2.0104 3.4482 C 0 0 0 0 0 0 0 0 0 0 0 0
7.8812 -2.0991 2.8562 H 0 0 0 0 0 0 0 0 0 0 0 0
6.9255 -0.7597 3.5314 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4231 -0.6920 1.8185 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0145 -3.1373 1.8803 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0963 -2.1275 3.0435 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0044 -1.2494 0.2982 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3316 -1.9549 0.6833 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7603 0.4992 1.9639 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2061 -0.1234 2.4923 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9747 0.6820 0.6389 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9353 1.9211 1.4209 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5387 2.1037 -0.4467 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8700 2.3467 -0.9401 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4086 -0.2310 -1.4696 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8811 1.0554 -2.6452 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0689 -0.6549 -0.8939 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4007 -0.9170 -2.6568 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6041 1.4644 -3.0939 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0919 1.5788 -1.4000 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9425 -0.4944 -3.3275 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2034 1.0329 -2.7696 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4236 0.2044 -0.3729 H 0 0 0 0 0 0 0 0 0 0 0 0
1.1568 -1.2754 -1.0128 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2632 -1.6592 -0.6197 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8005 -1.7841 -2.3681 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9018 -0.6835 -2.0176 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7121 0.3940 -2.8187 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1730 1.4992 -0.7139 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3526 0.5298 0.1866 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9038 2.5530 -2.0530 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2486 2.7013 -0.3210 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.6204 0.7350 -2.2466 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.2605 2.2142 -1.5099 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.9880 1.4442 0.6946 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3010 -0.1384 0.2171 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.4011 -0.6256 -1.1392 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.0605 0.8804 -0.5044 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.8794 -1.6529 0.9054 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.3077 -0.1796 4.3752 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.3788 -2.6611 2.5904 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.6992 -2.4865 4.3780 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