Monomers
2-(Diethylamino)ethyl methacrylate
Identifiers
IUPAC name
2-(diethylamino)ethyl 2-methylprop-2-enoate
InchI
InChI=1S/C10H19NO2/c1-5-11(6-2)7-8-13-10(12)9(3)4/h3,5-8H2,1-2,4H3
InchI Key
SJIXRGNQPBQWMK-UHFFFAOYSA-N
SMILES
CCN(CCOC(=O)C(=C)C)CC
Canonical SMILES
CCN(CC)CCOC(=O)C(=C)C
Isomeric SMILES
CCN(CC)CCOC(=O)C(=C)C
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C10H19NO2
Heavy Atom Count
13
Molecular Weight
185.267
Exact Molecular Weight
185.1416
Valence Electrons
76
Radical Electrons
0
tPSA
29.54
MolLogP
1.4475
H Bond Acceptors
3
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
32 31 0 0 0 0 0 0 0 0999 V2000
-3.5723 1.2851 0.3328 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0963 1.0323 0.3559 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6761 -0.0101 -0.4642 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.2433 -0.2183 -0.5071 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3725 -0.7384 0.7319 C 0 0 0 0 0 0 0 0 0 0 0 0
1.7759 -0.8682 0.4998 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5879 0.2421 0.2296 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0660 1.3847 0.2021 O 0 0 0 0 0 0 0 0 0 0 0 0
4.0125 0.1356 -0.0211 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6290 -1.0249 -0.0226 C 0 0 0 0 0 0 0 0 0 0 0 0
4.7896 1.3653 -0.2673 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3898 -1.2161 -0.5647 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.6702 -1.1177 -1.3157 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1509 0.5923 0.9760 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0374 1.3086 -0.6648 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7802 2.3225 0.7444 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7976 0.7475 1.4265 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5475 1.9959 0.2125 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0990 -1.0190 -1.2962 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1960 0.6868 -0.9394 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1983 -0.1043 1.6309 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0053 -1.7734 0.9158 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0627 -1.9141 0.1675 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6792 -1.1136 -0.2065 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8275 1.1785 -0.6033 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7746 1.9495 0.7006 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3228 2.0242 -1.0332 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7151 -2.0186 -1.0090 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6075 -1.5806 0.4758 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5787 -0.3959 -2.1566 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5268 -0.9983 -0.6635 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8004 -2.1393 -1.8136 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 2 0
7 9 1 0
9 10 2 3
9 11 1 0
3 12 1 0
12 13 1 0
1 14 1 0
1 15 1 0
1 16 1 0
2 17 1 0
2 18 1 0
4 19 1 0
4 20 1 0
5 21 1 0
5 22 1 0
10 23 1 0
10 24 1 0
11 25 1 0
11 26 1 0
11 27 1 0
12 28 1 0
12 29 1 0
13 30 1 0
13 31 1 0
13 32 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers