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
-1.5906 3.1287 0.2696 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7253 2.0256 1.1840 N 0 0 0 0 0 0 0 0 0 0 0 0
-1.2447 0.7598 0.7228 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2480 0.8296 0.4385 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7462 -0.3749 -0.0497 O 0 0 0 0 0 0 0 0 0 0 0 0
2.0456 -0.6396 -0.3801 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9227 0.2130 -0.2516 O 0 0 0 0 0 0 0 0 0 0 0 0
2.4037 -2.0032 -0.9140 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4918 -2.8801 -1.0386 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8223 -2.2327 -1.2125 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0088 0.2715 -0.3667 N 0 0 0 0 0 0 0 0 0 0 0 0
-3.1687 -0.4744 0.1014 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3476 3.9004 0.5715 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5796 3.6108 0.3218 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7650 2.9172 -0.7784 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1813 2.3011 2.0507 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3628 0.0782 1.6445 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4635 1.6223 -0.3013 H 0 0 0 0 0 0 0 0 0 0 0 0
0.7055 1.1424 1.4130 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6763 -3.8960 -1.4286 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4539 -2.6604 -0.7644 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0436 -2.4969 -2.2583 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2643 -3.0337 -0.5418 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4354 -1.3030 -0.9736 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3297 1.0458 -0.9625 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1051 -0.5285 1.2130 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.2285 -1.4595 -0.3879 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0853 0.1365 -0.0953 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