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
-4.9063 2.6795 -0.1141 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.2805 1.3487 -0.5198 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5152 0.7585 0.6450 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.9163 -0.5576 0.1879 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1200 -1.2237 1.2610 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5669 -2.5243 0.7480 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6911 -2.3208 -0.4507 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4922 -1.3935 -0.1290 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2718 -1.3099 -1.4280 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4341 -0.4080 -1.2380 C 0 0 0 0 0 0 0 0 0 0 0 0
3.4009 -0.8461 -0.1377 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4732 0.1801 -0.1495 C 0 0 0 0 0 0 0 0 0 0 0 0
5.0737 0.4089 -1.2216 O 0 0 0 0 0 0 0 0 0 0 0 0
4.8111 0.8762 0.9822 O 0 0 0 0 0 0 0 0 0 0 0 0
5.8186 1.8495 0.9880 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4795 3.0878 0.6705 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.9713 2.5160 0.1947 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3742 3.1011 0.7536 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.9333 3.3643 -0.9951 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.1056 0.6956 -0.8706 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6228 1.4880 -1.4090 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2061 0.5944 1.4930 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7708 1.4921 0.9689 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7749 -1.2198 -0.0807 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3676 -0.3371 -0.7325 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2644 -0.6081 1.6138 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7931 -1.4183 2.1297 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4258 -3.1618 0.4591 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9705 -3.0622 1.5188 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2690 -3.2948 -0.8151 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2055 -1.8784 -1.3244 H 0 0 0 0 0 0 0 0 0 0 0 0
1.0947 -1.8255 0.6796 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1171 -0.3788 0.1012 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6439 -0.8716 -2.2354 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6077 -2.3139 -1.7645 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0179 -0.1901 -2.1531 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0972 0.6145 -0.8882 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8680 -0.8971 0.8074 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8102 -1.8630 -0.3692 H 0 0 0 0 0 0 0 0 0 0 0 0
6.8060 1.5720 1.2437 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4916 3.4059 0.4106 H 0 0 0 0 0 0 0 0 0 0 0 0
6.2418 3.8710 0.6599 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