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
-5.8519 0.3918 -1.5128 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.5649 -1.0289 -1.0588 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1228 -1.2158 -0.6921 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6787 -0.3081 0.4446 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1889 -0.6457 0.6624 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7260 0.2178 1.7681 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3514 0.1373 2.2643 C 0 0 0 0 0 0 0 0 0 0 0 0
0.8179 0.5083 1.4400 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1072 -0.2000 0.1901 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4001 0.3177 -0.4734 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5422 0.0842 0.4402 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7679 0.5957 -0.2895 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9783 1.8299 -0.3213 O 0 0 0 0 0 0 0 0 0 0 0 0
5.6612 -0.2497 -0.9208 O 0 0 0 0 0 0 0 0 0 0 0 0
6.7392 0.3367 -1.5505 C 0 0 0 0 0 0 0 0 0 0 0 0
7.8529 0.5268 -0.9127 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.6048 1.0948 -0.7039 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.9307 0.4466 -1.7704 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.2672 0.6203 -2.4495 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.8328 -1.7471 -1.8502 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.2178 -1.1928 -0.1599 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0058 -2.2614 -0.3379 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4681 -0.9791 -1.5435 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2080 -0.5533 1.3791 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7854 0.7542 0.1531 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1122 -1.7392 0.9367 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6650 -0.5481 -0.2856 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8808 1.3029 1.4370 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4522 0.1016 2.6537 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2650 0.8026 3.2078 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1625 -0.8900 2.7721 H 0 0 0 0 0 0 0 0 0 0 0 0
1.7563 0.5286 2.0869 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7120 1.6164 1.1688 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3447 -0.0732 -0.6180 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2600 -1.2896 0.3038 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5686 -0.2334 -1.4099 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3100 1.4102 -0.6583 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5337 0.6586 1.3718 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7006 -0.9798 0.6664 H 0 0 0 0 0 0 0 0 0 0 0 0
6.6412 0.6326 -2.5762 H 0 0 0 0 0 0 0 0 0 0 0 0
7.9609 0.2331 0.1124 H 0 0 0 0 0 0 0 0 0 0 0 0
8.6881 0.9867 -1.4067 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