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
-8.3999 -2.4105 -1.3526 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.5853 -1.8812 -0.1991 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.1602 -0.4416 -0.4301 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.3585 -0.0240 0.7790 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.8753 1.4024 0.6770 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.9947 1.6540 -0.4970 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.7423 0.8056 -0.4934 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8880 1.0315 0.7029 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6732 0.1413 0.6356 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8390 0.4036 -0.5732 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3821 -0.4687 -0.6554 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3184 -0.3092 0.5030 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8397 1.0941 0.6494 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5940 1.6123 -0.5005 C 0 0 0 0 0 0 0 0 0 0 0 0
3.7729 0.9323 -1.0290 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9904 0.7078 -0.2194 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9211 -0.1569 0.9701 C 0 0 0 0 0 0 0 0 0 0 0 0
6.3078 -0.2646 1.6186 C 0 0 0 0 0 0 0 0 0 0 0 0
7.2013 -0.8725 0.6764 N 0 0 0 0 0 0 0 0 0 0 0 0
8.5851 -1.0965 0.9795 C 0 0 0 0 0 0 0 0 0 0 0 0
8.9511 -0.7206 2.1283 O 0 0 0 0 0 0 0 0 0 0 0 0
9.5185 -1.7034 0.0641 C 0 0 0 0 0 0 0 0 0 0 0 0
9.2033 -2.1138 -1.1385 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.7652 -3.0534 -1.9879 H 0 0 0 0 0 0 0 0 0 0 0 0
-9.3477 -2.8680 -1.0531 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.6578 -1.5223 -1.9973 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.6962 -2.5105 -0.0757 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.1838 -1.9168 0.7303 H 0 0 0 0 0 0 0 0 0 0 0 0
-8.0468 0.2084 -0.5668 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.5451 -0.3458 -1.3458 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.5150 -0.6875 0.9788 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.0120 -0.0738 1.6955 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.8046 2.0247 0.5168 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.4097 1.6526 1.6488 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.5488 1.4123 -1.4242 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.6863 2.7091 -0.6007 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9587 -0.2617 -0.6838 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1624 1.1652 -1.3948 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4871 2.0831 0.7435 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4136 0.8921 1.6656 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0417 0.2392 1.5479 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0106 -0.9362 0.6327 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4343 0.1596 -1.5046 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5612 1.4605 -0.6708 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0793 -1.5194 -0.7427 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9054 -0.2156 -1.6113 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8047 -0.5813 1.4460 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1944 -0.9975 0.4344 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3515 1.2229 1.5962 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9223 1.7932 0.7435 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9522 2.6612 -0.1822 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8835 1.9177 -1.3559 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5029 -0.1069 -1.4519 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1371 1.5385 -1.9395 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8073 0.3014 -0.8992 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4552 1.7098 0.0981 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6430 -1.2072 0.7144 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2128 0.1732 1.7343 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6266 0.7698 1.9044 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1637 -0.8675 2.5403 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8936 -1.1867 -0.2546 H 0 0 0 0 0 0 0 0 0 0 0 0
10.5563 -1.8283 0.3973 H 0 0 0 0 0 0 0 0 0 0 0 0
9.9229 -2.5667 -1.8073 H 0 0 0 0 0 0 0 0 0 0 0 0
8.2050 -2.0161 -1.5143 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