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
-2.5308 -2.3622 0.3250 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.5371 -1.2602 -0.7256 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1584 -0.0467 -0.0782 N 0 0 0 0 0 0 0 0 0 0 0 0
-0.8240 0.0297 0.3650 C 0 0 0 0 0 0 0 0 0 0 0 0
0.1609 0.1121 -0.8002 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4437 0.1865 -0.1916 O 0 0 0 0 0 0 0 0 0 0 0 0
2.6286 0.2876 -0.9021 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5616 0.3150 -2.1513 O 0 0 0 0 0 0 0 0 0 0 0 0
3.9018 0.3603 -0.1708 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8286 0.3135 1.1560 C 0 0 0 0 0 0 0 0 0 0 0 0
5.1984 0.4884 -0.8477 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.1676 0.6008 0.6612 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7999 1.8968 1.2986 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.5610 -2.7990 0.4366 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.3063 -1.9462 1.3474 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8121 -3.1715 0.0771 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5691 -1.1824 -1.1261 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8991 -1.5254 -1.5889 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5949 -0.9894 0.8210 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.5690 0.8177 1.0863 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0253 1.0235 -1.4011 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1059 -0.7715 -1.4612 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8953 0.2259 1.6813 H 0 0 0 0 0 0 0 0 0 0 0 0
4.7518 0.3687 1.7044 H 0 0 0 0 0 0 0 0 0 0 0 0
6.0177 0.7834 -0.1332 H 0 0 0 0 0 0 0 0 0 0 0 0
5.1929 1.3250 -1.6017 H 0 0 0 0 0 0 0 0 0 0 0 0
5.4890 -0.4802 -1.2912 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4933 -0.0894 1.4962 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0756 0.7285 0.0412 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.7407 2.2899 1.7725 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5261 2.6815 0.5558 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0368 1.7892 2.0860 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