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
2.1909 -2.1366 -0.9672 C 0 0 0 0 0 0 0 0 0 0 0 0
2.6812 -0.7082 -0.8789 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9308 -0.0753 0.2185 N 0 0 0 0 0 0 0 0 0 0 0 0
0.5438 0.0106 -0.2373 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3117 0.5136 0.8661 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6849 0.6178 0.4920 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.4708 -0.4320 0.0749 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9801 -1.5748 0.0022 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.8564 -0.2023 -0.2756 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.5977 -1.2063 -0.6798 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4870 1.1479 -0.1873 C 0 0 0 0 0 0 0 0 0 0 0 0
2.4175 1.2883 0.3909 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8469 1.3095 0.9152 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0423 -2.8710 -0.9669 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6306 -2.3413 -1.8985 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5921 -2.4166 -0.0593 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7612 -0.7227 -0.6903 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4820 -0.2167 -1.8273 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1946 -0.9746 -0.6237 H 0 0 0 0 0 0 0 0 0 0 0 0
0.4480 0.6956 -1.1183 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1902 -0.1627 1.7370 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0632 1.5255 1.2457 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.6355 -1.0466 -0.9446 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.1809 -2.2060 -0.7549 H 0 0 0 0 0 0 0 0 0 0 0 0
-5.2919 1.1936 -0.9508 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7783 1.9702 -0.3006 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.9740 1.2008 0.8317 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4337 1.8138 -0.5837 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8205 1.8614 1.1182 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5616 0.9218 0.1814 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0670 2.4066 1.0747 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8579 0.8167 1.8983 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