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
Resources
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
-6.3462 2.6938 0.2247 C 0 0 0 0 0 0 0 0 0 0 0 0
-6.8026 1.2743 -0.0814 C 0 0 0 0 0 0 0 0 0 0 0 0
-5.7678 0.2697 0.4059 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4361 0.4798 -0.2566 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.4774 -0.5415 0.2725 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0980 -0.4105 -0.3393 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.2358 -1.4866 0.2718 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1814 -1.4621 -0.2624 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9277 -2.5814 0.4279 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3570 -2.7070 0.0152 C 0 0 0 0 0 0 0 0 0 0 0 0
3.1515 -1.4459 0.3088 C 0 0 0 0 0 0 0 0 0 0 0 0
4.5879 -1.5928 -0.1117 C 0 0 0 0 0 0 0 0 0 0 0 0
5.2933 -0.4188 0.1792 O 0 0 0 0 0 0 0 0 0 0 0 0
4.9706 0.7801 -0.3993 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0214 0.9121 -1.2356 O 0 0 0 0 0 0 0 0 0 0 0 0
5.7357 1.9968 -0.0624 C 0 0 0 0 0 0 0 0 0 0 0 0
5.4265 3.1334 -0.6135 C 0 0 0 0 0 0 0 0 0 0 0 0
6.8572 1.9046 0.9095 C 0 0 0 0 0 0 0 0 0 0 0 0
-7.2415 3.3485 0.0291 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.4671 2.9904 -0.3503 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.1640 2.7491 1.3195 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.9971 1.1533 -1.1610 H 0 0 0 0 0 0 0 0 0 0 0 0
-7.7297 1.1136 0.5000 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.7180 0.3053 1.5060 H 0 0 0 0 0 0 0 0 0 0 0 0
-6.1446 -0.7276 0.1019 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5692 0.2812 -1.3432 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0210 1.4742 -0.0721 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8078 -1.5857 0.0826 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3974 -0.4455 1.3766 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7436 0.6052 -0.1386 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1987 -0.5194 -1.4378 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6692 -2.4611 0.0088 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1949 -1.3173 1.3487 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6841 -0.5042 0.0625 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2366 -1.5547 -1.3479 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4147 -3.5273 0.1258 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8097 -2.4792 1.5281 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4309 -3.0103 -1.0287 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8105 -3.5078 0.6285 H 0 0 0 0 0 0 0 0 0 0 0 0
3.0454 -1.1753 1.3777 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6836 -0.6509 -0.2739 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0430 -2.4900 0.3737 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5664 -1.7519 -1.2306 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6144 3.1985 -1.3169 H 0 0 0 0 0 0 0 0 0 0 0 0
5.9781 4.0202 -0.3731 H 0 0 0 0 0 0 0 0 0 0 0 0
7.2706 0.8820 0.9642 H 0 0 0 0 0 0 0 0 0 0 0 0
6.4877 2.1747 1.9345 H 0 0 0 0 0 0 0 0 0 0 0 0
7.6418 2.6138 0.6353 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