Monomers
2,2-Dimethylaminoethyl methacrylate
Identifiers
IUPAC name
2,2-bis(methylamino)ethyl 2-methylprop-2-enoate
InchI
InChI=1S/C8H16N2O2/c1-6(2)8(11)12-5-7(9-3)10-4/h7,9-10H,1,5H2,2-4H3
InchI Key
DXDMKLZVAJPSSQ-UHFFFAOYSA-N
SMILES
CNC(COC(=O)C(=C)C)NC
Canonical SMILES
CC(=C)C(=O)OCC(NC)NC
Isomeric SMILES
CC(=C)C(=O)OCC(NC)NC
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C8H16N2O2
Heavy Atom Count
12
Molecular Weight
172.228
Exact Molecular Weight
172.1212
Valence Electrons
70
Radical Electrons
0
tPSA
50.36
MolLogP
-0.1294
H Bond Acceptors
4
H Bond Donors
2
Aliphatic Carbocycles
0
Aromatic Carbocycles
0
Aliphatic Heterocycles
0
Aromatic Heterocycles
0
Aliphatic Rings
0
Aromatic Rings
0
MOL File
RDKit 3D
28 27 0 0 0 0 0 0 0 0999 V2000
-1.8578 -1.9892 0.1157 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.3388 -1.1138 -0.9314 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.4454 0.2633 -0.5962 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6384 0.7693 0.5406 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7431 0.7330 0.4368 O 0 0 0 0 0 0 0 0 0 0 0 0
1.6378 -0.2562 0.2738 C 0 0 0 0 0 0 0 0 0 0 0 0
1.1908 -1.4285 0.1893 O 0 0 0 0 0 0 0 0 0 0 0 0
3.0965 -0.0496 0.1893 C 0 0 0 0 0 0 0 0 0 0 0 0
3.6105 1.1416 0.2716 C 0 0 0 0 0 0 0 0 0 0 0 0
3.9768 -1.2164 0.0094 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8578 0.5081 -0.2362 N 0 0 0 0 0 0 0 0 0 0 0 0
-3.0343 1.9383 -0.1141 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5148 -1.5715 1.0907 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4664 -2.9976 -0.0538 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9619 -1.9672 0.0786 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9111 -1.2876 -1.7746 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2073 0.8673 -1.5005 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8959 1.8788 0.6256 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.0072 0.3681 1.5221 H 0 0 0 0 0 0 0 0 0 0 0 0
4.6657 1.3040 0.2108 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9596 1.9841 0.4016 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1976 -1.7225 0.9891 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4983 -2.0193 -0.6088 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9446 -0.9468 -0.4483 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0454 0.0207 0.6893 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8592 2.2319 0.9333 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0889 2.1384 -0.4219 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3909 2.4195 -0.8565 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 2 0
6 8 1 0
8 9 2 3
8 10 1 0
3 11 1 0
11 12 1 0
1 13 1 0
1 14 1 0
1 15 1 0
2 16 1 0
3 17 1 0
4 18 1 0
4 19 1 0
9 20 1 0
9 21 1 0
10 22 1 0
10 23 1 0
10 24 1 0
11 25 1 0
12 26 1 0
12 27 1 0
12 28 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers