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
5.1629 2.7730 -0.0232 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0019 1.3659 -0.5611 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5136 1.0542 -0.5772 C 0 0 0 0 0 0 0 0 0 0 0 0
3.2342 -0.3163 -1.0921 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7162 -0.5440 -1.0953 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1076 -0.4397 0.2533 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3961 -0.6538 0.1955 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.7047 -2.0014 -0.3045 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1034 -2.4371 -0.4574 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0338 -2.5638 0.6530 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4132 -1.4049 1.4879 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0155 -0.2657 0.7466 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1882 -0.3416 -0.4862 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.4058 0.9057 1.3640 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.9677 1.9626 0.6565 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2457 2.9267 0.1277 C 0 0 0 0 0 0 0 0 0 0 0 0
5.8134 3.3914 -0.6763 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1878 3.2951 0.0891 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6194 2.7729 0.9960 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4118 1.3695 -1.6091 H 0 0 0 0 0 0 0 0 0 0 0 0
5.5359 0.6754 0.0960 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9523 1.8064 -1.1304 H 0 0 0 0 0 0 0 0 0 0 0 0
3.2000 1.1321 0.5053 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5776 -0.3720 -2.1543 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7489 -1.1143 -0.5565 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2278 0.2523 -1.7324 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5173 -1.4841 -1.6466 H 0 0 0 0 0 0 0 0 0 0 0 0
1.3473 0.5075 0.7808 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5258 -1.2558 0.8816 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7632 0.1698 -0.4848 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8081 -0.4912 1.2126 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2066 -2.1501 -1.3077 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1445 -2.7338 0.3482 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0373 -3.4390 -1.0276 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5909 -1.7881 -1.2792 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9739 -3.0648 0.2550 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6031 -3.3575 1.3683 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2318 -1.7634 2.2461 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6581 -1.0193 2.1772 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.0387 2.0078 0.5273 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.6947 3.7345 -0.4149 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1768 2.8987 0.2459 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