Monomers
Dodecyl methacrylate
Identifiers
IUPAC name
dodecyl 2-methylprop-2-enoate
InchI
InChI=1S/C16H30O2/c1-4-5-6-7-8-9-10-11-12-13-14-18-16(17)15(2)3/h2,4-14H2,1,3H3
InchI Key
GMSCBRSQMRDRCD-UHFFFAOYSA-N
SMILES
CCCCCCCCCCCCOC(=O)C(=C)C
Canonical SMILES
CCCCCCCCCCCCOC(=O)C(=C)C
Isomeric SMILES
CCCCCCCCCCCCOC(=O)C(=C)C
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C16H30O2
Heavy Atom Count
18
Molecular Weight
254.414
Exact Molecular Weight
254.2246
Valence Electrons
106
Radical Electrons
0
tPSA
26.3
MolLogP
5.0266
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
48 47 0 0 0 0 0 0 0 0999 V2000
4.0925 1.1053 2.1345 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3151 0.6426 1.4054 C 0 0 0 0 0 0 0 0 0 0 0 0
5.3060 -0.8255 1.0980 C 0 0 0 0 0 0 0 0 0 0 0 0
4.1520 -1.2556 0.2381 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0947 -0.6007 -1.0892 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9124 -1.1094 -1.8690 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5844 -0.8687 -1.2356 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5039 -1.4190 -2.1284 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.8897 -1.2419 -1.5871 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1748 0.2122 -1.4064 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5713 0.4637 -0.8697 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7939 -0.1782 0.4590 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0874 0.0512 0.9577 O 0 0 0 0 0 0 0 0 0 0 0 0
-4.6510 1.2706 1.2411 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9511 2.2926 1.0401 O 0 0 0 0 0 0 0 0 0 0 0 0
-5.9997 1.4351 1.7554 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.4420 2.6547 1.9934 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.8731 0.2496 2.0114 C 0 0 0 0 0 0 0 0 0 0 0 0
4.3397 1.8635 2.9346 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5348 0.3120 2.6390 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4019 1.6556 1.4455 H 0 0 0 0 0 0 0 0 0 0 0 0
6.1888 0.8334 2.0639 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4959 1.2638 0.4909 H 0 0 0 0 0 0 0 0 0 0 0 0
6.2756 -1.0930 0.6402 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2193 -1.3636 2.0666 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1933 -2.3605 0.1501 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1915 -1.0302 0.7759 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9239 0.4987 -0.9390 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9900 -0.7662 -1.7201 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8712 -0.6700 -2.8982 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0137 -2.2154 -2.0501 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5051 -1.3582 -0.2516 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4223 0.2386 -1.1339 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7126 -2.5095 -2.3110 H 0 0 0 0 0 0 0 0 0 0 0 0
0.5694 -0.9512 -3.1493 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.9752 -1.8248 -0.6418 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5802 -1.6584 -2.3420 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4789 0.7187 -0.7032 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1027 0.6972 -2.4015 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6905 1.5605 -0.7660 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3473 0.1140 -1.5730 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0139 0.2106 1.1766 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6404 -1.2735 0.4408 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.4260 2.7834 2.3692 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.8393 3.5214 1.8196 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.3757 0.4269 2.9737 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.6297 0.1758 1.2112 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.2765 -0.6781 1.9968 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 1 0
13 14 1 0
14 15 2 0
14 16 1 0
16 17 2 3
16 18 1 0
1 19 1 0
1 20 1 0
1 21 1 0
2 22 1 0
2 23 1 0
3 24 1 0
3 25 1 0
4 26 1 0
4 27 1 0
5 28 1 0
5 29 1 0
6 30 1 0
6 31 1 0
7 32 1 0
7 33 1 0
8 34 1 0
8 35 1 0
9 36 1 0
9 37 1 0
10 38 1 0
10 39 1 0
11 40 1 0
11 41 1 0
12 42 1 0
12 43 1 0
17 44 1 0
17 45 1 0
18 46 1 0
18 47 1 0
18 48 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers