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
-1.5112 -2.1451 -0.5770 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.2537 -1.3226 0.2607 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.0098 0.0551 0.3465 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6780 0.4605 0.8649 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4315 0.0018 0.1294 O 0 0 0 0 0 0 0 0 0 0 0 0
1.7028 0.3472 0.5641 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7444 1.0695 1.6199 O 0 0 0 0 0 0 0 0 0 0 0 0
2.9163 -0.0540 -0.0915 C 0 0 0 0 0 0 0 0 0 0 0 0
4.0807 0.3210 0.3925 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8984 -0.8928 -1.3116 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3569 0.7878 -0.8833 N 0 0 0 0 0 0 0 0 0 0 0 0
-2.4627 2.1939 -0.6501 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6873 -1.6365 -1.0660 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2165 -3.0747 -0.0276 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1808 -2.5075 -1.4177 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1149 -1.6876 0.6802 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7650 0.4642 1.0936 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5662 0.1405 1.9175 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6564 1.5927 0.9195 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0787 0.9344 1.2914 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0070 0.0288 -0.0871 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9256 -1.0183 -1.7295 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5910 -1.9199 -0.9758 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2809 -0.4964 -2.1228 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6358 0.6287 -1.5972 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0664 2.7047 -1.4227 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0290 2.3238 0.3125 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4668 2.7008 -0.5977 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