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
-3.6802 1.4046 0.1954 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1900 1.2712 0.2695 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7508 -0.0039 0.6658 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.3578 -0.2342 0.7209 C 0 0 0 0 0 0 0 0 0 0 0 0
0.2186 -0.2476 -0.6505 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5884 -0.4679 -0.6463 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5295 0.3431 -0.0393 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1126 1.3587 0.5602 O 0 0 0 0 0 0 0 0 0 0 0 0
3.9176 -0.0191 -0.1294 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2863 -1.0972 -0.7706 C 0 0 0 0 0 0 0 0 0 0 0 0
4.9499 0.8414 0.4847 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6135 -1.1081 0.5791 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8970 -1.4231 -0.8668 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.0506 2.0220 1.0670 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9995 2.0207 -0.6981 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2515 0.4830 0.1664 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8186 1.4793 -0.7784 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7403 2.1130 0.8635 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2109 -1.2818 1.1281 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1854 0.4062 1.4464 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2536 -1.1350 -1.1715 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0803 0.6108 -1.2964 H 0 0 0 0 0 0 0 0 0 0 0 0
3.5384 -1.7179 -1.2333 H 0 0 0 0 0 0 0 0 0 0 0 0
5.3189 -1.3993 -0.8643 H 0 0 0 0 0 0 0 0 0 0 0 0
4.5354 1.4567 1.2833 H 0 0 0 0 0 0 0 0 0 0 0 0
5.2735 1.5528 -0.3364 H 0 0 0 0 0 0 0 0 0 0 0 0
5.8598 0.2758 0.8026 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5271 -1.0740 1.2058 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0440 -1.9998 1.0004 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9832 -1.5302 -1.0703 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5341 -0.5847 -1.5058 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3313 -2.3156 -1.1681 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