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
-6.8775 -0.5676 0.0715 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.3684 -0.7627 -0.1551 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.7607 0.5338 -0.5556 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.2645 0.3869 -0.8061 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5440 -0.0764 0.4118 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0531 -0.2619 0.0963 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4742 1.0031 -0.3315 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9177 1.1834 -0.7206 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0743 0.9337 0.1276 C 0 0 0 0 0 0 0 0 0 0 0 0
2.2721 -0.4894 0.5355 C 0 0 0 0 0 0 0 0 0 0 0 0
3.5085 -0.6892 1.4092 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7515 -0.3495 0.7113 C 0 0 0 0 0 0 0 0 0 0 0 0
4.8442 -0.0243 -0.4894 O 0 0 0 0 0 0 0 0 0 0 0 0
5.9648 -0.3816 1.4238 O 0 0 0 0 0 0 0 0 0 0 0 0
7.1469 -0.0656 0.7859 C 0 0 0 0 0 0 0 0 0 0 0 0
7.9062 -0.9501 0.1744 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.2992 -0.2337 -0.8895 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.0383 0.2435 0.8281 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.3206 -1.4802 0.4775 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.2592 -1.5323 -0.9443 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.9168 -1.1078 0.8121 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.8872 1.3265 0.2008 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.2026 0.9047 -1.4970 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8997 1.4361 -1.0468 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0558 -0.2213 -1.7029 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6371 0.6924 1.2358 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9317 -1.0239 0.8454 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0164 -1.0103 -0.7233 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6798 -0.6865 1.0602 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8429 1.8248 0.3773 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0664 1.3014 -1.2840 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9977 2.2915 -1.0417 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0956 0.7021 -1.7571 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0387 1.2564 -0.3835 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1012 1.5851 1.0556 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4433 -1.0087 0.9882 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4876 -1.0679 -0.4261 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5664 -1.7639 1.6882 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4016 -0.1280 2.3634 H 0 0 0 0 0 0 0 0 0 0 0 0
7.4634 0.9637 0.7905 H 0 0 0 0 0 0 0 0 0 0 0 0
7.5855 -1.9792 0.1724 H 0 0 0 0 0 0 0 0 0 0 0 0
8.8290 -0.7072 -0.3240 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