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
-7.9952 -1.3256 -2.2463 C 0 0 0 0 0 0 0 0 0 0 0 0
-8.4455 -1.6664 -0.8364 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.5384 -0.9236 0.1212 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.1220 -1.3341 -0.0710 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.1702 -0.6064 0.8808 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.2051 0.8542 0.7032 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.3442 1.6175 1.6229 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8910 1.5351 1.6434 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1657 0.2845 1.9223 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6349 0.5341 1.9848 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0882 1.0714 0.7112 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4009 1.2730 0.8813 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1397 0.0105 1.2079 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6252 0.2454 1.3642 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2596 0.7997 0.1122 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0918 -0.1352 -1.0659 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7651 0.5304 -2.2564 C 0 0 0 0 0 0 0 0 0 0 0 0
6.2248 0.7745 -2.0150 C 0 0 0 0 0 0 0 0 0 0 0 0
6.9516 -0.4453 -1.7581 N 0 0 0 0 0 0 0 0 0 0 0 0
8.3349 -0.4669 -1.5035 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9480 0.6308 -1.5035 O 0 0 0 0 0 0 0 0 0 0 0 0
9.0648 -1.6883 -1.2458 C 0 0 0 0 0 0 0 0 0 0 0 0
10.3541 -1.6787 -1.0116 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.4655 -2.1809 -2.7313 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.3464 -0.4362 -2.2729 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.9276 -1.0628 -2.8111 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.4855 -1.3828 -0.6455 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.3039 -2.7692 -0.6991 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.7351 0.1383 -0.0054 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.8614 -1.1952 1.1662 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.8050 -1.1639 -1.1178 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.0026 -2.4163 0.1328 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.4332 -0.8486 1.9364 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2007 -1.0283 0.6806 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.2625 1.2613 0.8323 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.8757 1.1189 -0.3479 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.6303 2.7338 1.4568 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.6953 1.4836 2.7103 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4742 2.0384 0.6935 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5417 2.2725 2.4563 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2077 -0.4663 1.0700 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4195 -0.1819 2.8871 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2157 -0.4778 2.1384 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3970 1.1493 2.8716 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3108 0.3641 -0.1259 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5010 2.0471 0.3846 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5121 1.9483 1.7777 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8394 1.7758 -0.0150 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8789 -0.7616 0.4881 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7966 -0.3424 2.2250 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7508 1.0150 2.1560 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1625 -0.6526 1.6937 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8771 1.8077 -0.1005 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3465 0.8743 0.3208 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0467 -0.3524 -1.2937 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5941 -1.1049 -0.8728 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5628 -0.0293 -3.1792 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3029 1.5474 -2.4225 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6288 1.1875 -2.9855 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4280 1.5451 -1.2663 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4318 -1.3490 -1.7608 H 0 0 0 0 0 0 0 0 0 0 0 0
8.5580 -2.6548 -1.2398 H 0 0 0 0 0 0 0 0 0 0 0 0
10.8979 -0.7248 -1.0096 H 0 0 0 0 0 0 0 0 0 0 0 0
10.9234 -2.5646 -0.8174 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