Monomers
Vinyl laurate
Identifiers
IUPAC name
ethenyl dodecanoate
InchI
InChI=1S/C14H26O2/c1-3-5-6-7-8-9-10-11-12-13-14(15)16-4-2/h4H,2-3,5-13H2,1H3
InchI Key
GLVVKKSPKXTQRB-UHFFFAOYSA-N
SMILES
CCCCCCCCCCCC(=O)OC=C
Canonical SMILES
CCCCCCCCCCCC(=O)OC=C
Isomeric SMILES
CCCCCCCCCCCC(=O)OC=C
Resources
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C14H26O2
Heavy Atom Count
16
Molecular Weight
226.36
Exact Molecular Weight
226.1933
Valence Electrons
94
Radical Electrons
0
tPSA
26.3
MolLogP
4.594
H Bond Acceptors
2
H Bond Donors
0
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0
MOL File
RDKit 3D
42 41 0 0 0 0 0 0 0 0999 V2000
-5.0268 -2.4559 0.1363 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2978 -1.5336 -0.8118 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5776 -0.0987 -0.4995 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1731 0.3298 0.8704 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6939 0.1694 1.1500 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8636 0.9952 0.1758 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4137 0.7869 0.5225 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5193 1.5523 -0.3740 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9370 1.2235 0.1341 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9624 1.9322 -0.6869 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3422 1.6253 -0.1905 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6656 0.2018 -0.2826 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9133 -0.6767 -0.7598 O 0 0 0 0 0 0 0 0 0 0 0 0
5.9073 -0.2480 0.1917 O 0 0 0 0 0 0 0 0 0 0 0 0
6.2411 -1.5875 0.1177 C 0 0 0 0 0 0 0 0 0 0 0 0
5.9472 -2.3967 1.1138 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.1088 -2.5000 -0.1785 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.9302 -2.1781 1.1905 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.6459 -3.4889 0.0247 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.6579 -1.7301 -1.8375 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2155 -1.7944 -0.7413 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.6541 0.0746 -0.6070 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0317 0.5374 -1.2381 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.7107 -0.1815 1.6748 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.4146 1.4129 0.9629 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3939 -0.8908 1.1369 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5176 0.5369 2.1814 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0128 0.6214 -0.8506 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1241 2.0529 0.2103 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1576 -0.2928 0.4168 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2129 1.0613 1.5623 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3864 2.6411 -0.3249 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5110 1.1791 -1.4262 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9797 0.1237 0.1040 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9790 1.5125 1.2137 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8295 1.6580 -1.7643 H 0 0 0 0 0 0 0 0 0 0 0 0
2.7870 3.0425 -0.5654 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4490 1.9006 0.9025 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1131 2.2750 -0.6854 H 0 0 0 0 0 0 0 0 0 0 0 0
6.7365 -1.9526 -0.7522 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1825 -3.4518 1.1133 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4455 -1.9880 1.9766 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 2 0
12 14 1 0
14 15 1 0
15 16 2 3
1 17 1 0
1 18 1 0
1 19 1 0
2 20 1 0
2 21 1 0
3 22 1 0
3 23 1 0
4 24 1 0
4 25 1 0
5 26 1 0
5 27 1 0
6 28 1 0
6 29 1 0
7 30 1 0
7 31 1 0
8 32 1 0
8 33 1 0
9 34 1 0
9 35 1 0
10 36 1 0
10 37 1 0
11 38 1 0
11 39 1 0
15 40 1 0
16 41 1 0
16 42 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers