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
-4.9939 -1.9198 0.6680 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.0774 -1.0654 -0.5647 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.2291 0.3728 -0.1755 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0583 0.8320 0.6513 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7495 0.6973 -0.1257 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5846 1.1813 0.7473 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3296 1.0269 -0.0851 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9013 1.4683 0.6463 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0839 1.2611 -0.3165 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3532 1.6847 0.3345 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5075 1.4964 -0.6089 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5960 0.0578 -0.9637 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9260 -0.4879 -1.8673 O 0 0 0 0 0 0 0 0 0 0 0 0
5.4791 -0.7894 -0.2657 O 0 0 0 0 0 0 0 0 0 0 0 0
5.5631 -2.1272 -0.5955 C 0 0 0 0 0 0 0 0 0 0 0 0
6.4121 -2.9015 0.0788 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.3601 -1.3302 1.5242 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9176 -2.2024 0.8410 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.5982 -2.8332 0.5256 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.9515 -1.3665 -1.2076 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1958 -1.2865 -1.1967 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.2459 0.9837 -1.1097 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.1380 0.4762 0.4299 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2398 1.8979 0.9257 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9801 0.2132 1.5827 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8169 1.2887 -1.0545 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5716 -0.3568 -0.4144 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5314 0.5544 1.6640 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7779 2.2113 1.0673 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2359 -0.0356 -0.3603 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4504 1.6974 -0.9617 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0701 0.7201 1.4764 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8828 2.4845 1.0409 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9450 1.8359 -1.2539 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1317 0.1869 -0.5973 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5171 1.0366 1.2225 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3254 2.7556 0.6255 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3263 2.1117 -1.5361 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4622 1.8616 -0.1750 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9878 -2.6199 -1.3714 H 0 0 0 0 0 0 0 0 0 0 0 0
7.0281 -2.4846 0.8753 H 0 0 0 0 0 0 0 0 0 0 0 0
6.5347 -3.9545 -0.1200 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