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
-3.9198 1.1869 -0.2420 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4210 1.2504 -0.4022 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.7444 0.0528 -0.2491 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.3314 0.0508 -0.4072 C 0 0 0 0 0 0 0 0 0 0 0 0
0.4366 0.7731 0.6442 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8063 0.7020 0.3761 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5150 -0.4685 0.3347 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9468 -1.5611 0.5500 O 0 0 0 0 0 0 0 0 0 0 0 0
3.9449 -0.4815 0.0398 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6128 -1.6102 0.0042 C 0 0 0 0 0 0 0 0 0 0 0 0
4.6195 0.8409 -0.2255 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3514 -1.1151 0.2014 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7579 -1.0714 1.6306 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.1469 0.9116 0.7968 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.4028 2.1475 -0.5266 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3644 0.4208 -0.9412 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0624 2.1110 0.2149 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2536 1.6175 -1.4646 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0175 -1.0111 -0.4194 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0999 0.4159 -1.4360 H 0 0 0 0 0 0 0 0 0 0 0 0
0.3001 0.2898 1.6590 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1590 1.8393 0.7450 H 0 0 0 0 0 0 0 0 0 0 0 0
5.6588 -1.6281 -0.2106 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0992 -2.5285 0.1929 H 0 0 0 0 0 0 0 0 0 0 0 0
4.3640 1.4926 0.6493 H 0 0 0 0 0 0 0 0 0 0 0 0
5.7055 0.7156 -0.3463 H 0 0 0 0 0 0 0 0 0 0 0 0
4.1105 1.2687 -1.1094 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1884 -1.3964 -0.4759 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6101 -1.9616 0.0790 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2389 -1.8783 2.2244 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8645 -1.2354 1.7604 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5038 -0.1400 2.1412 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