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
-6.4649 -0.4816 -0.9898 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.1736 -0.5255 -1.7315 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9632 -0.5788 -0.7777 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9350 0.6200 0.1030 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8778 0.7073 1.0960 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4538 0.7623 0.8072 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7273 -0.3024 0.1301 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7688 0.0559 -0.0197 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4620 0.2609 1.2843 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8991 0.6005 1.0931 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6337 -0.4820 0.3863 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0779 -0.1013 0.2457 C 0 0 0 0 0 0 0 0 0 0 0 0
5.5385 0.9769 0.6771 O 0 0 0 0 0 0 0 0 0 0 0 0
5.9375 -0.9827 -0.3895 O 0 0 0 0 0 0 0 0 0 0 0 0
7.2775 -0.6825 -0.5464 C 0 0 0 0 0 0 0 0 0 0 0 0
7.7068 -0.0411 -1.6166 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.0116 0.4889 -1.1377 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.3777 -0.7296 0.0909 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.1394 -1.2594 -1.4196 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.0578 0.3881 -2.3231 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.1117 -1.4071 -2.3942 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1139 -1.4915 -0.1712 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1238 -0.7223 -1.4552 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.9186 0.5655 0.6881 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0991 1.5743 -0.4835 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0952 -0.1215 1.8720 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1042 1.6260 1.7569 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9415 0.9070 1.8251 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1871 1.7563 0.3077 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0088 -0.6128 -0.8691 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7095 -1.2502 0.7497 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7864 1.0348 -0.5743 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2597 -0.7496 -0.6169 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9731 1.0521 1.9085 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4234 -0.6727 1.8888 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3381 0.7622 2.1072 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9923 1.5857 0.5867 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5359 -1.4259 0.9395 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1954 -0.6122 -0.6316 H 0 0 0 0 0 0 0 0 0 0 0 0
8.0017 -0.9641 0.1990 H 0 0 0 0 0 0 0 0 0 0 0 0
7.0370 0.2714 -2.4036 H 0 0 0 0 0 0 0 0 0 0 0 0
8.7503 0.2008 -1.7541 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