Monomers
Ethyl methacrylate
Identifiers
IUPAC name
ethyl 2-methylprop-2-enoate
InchI
InChI=1S/C6H10O2/c1-4-8-6(7)5(2)3/h2,4H2,1,3H3
InchI Key
SUPCQIBBMFXVTL-UHFFFAOYSA-N
SMILES
CCOC(=O)C(=C)C
Canonical SMILES
CCOC(=O)C(=C)C
Isomeric SMILES
CCOC(=O)C(=C)C
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C6H10O2
Heavy Atom Count
8
Molecular Weight
114.144
Exact Molecular Weight
114.0681
Valence Electrons
46
Radical Electrons
0
tPSA
26.3
MolLogP
1.1256
H Bond Acceptors
2
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
18 17 0 0 0 0 0 0 0 0999 V2000
-2.7809 -0.2157 0.0989 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8147 -0.6256 1.1571 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4925 -0.7896 0.6967 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2284 0.2447 0.1155 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.3343 1.3442 0.0088 O 0 0 0 0 0 0 0 0 0 0 0 0
1.5951 0.0380 -0.3496 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1668 -1.1334 -0.2252 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3231 1.1528 -0.9573 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.8026 -0.5070 0.4443 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8165 0.8747 -0.0838 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5557 -0.7949 -0.8317 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7890 0.1953 1.9213 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.1959 -1.5218 1.6623 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1699 -1.2809 -0.5677 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6486 -1.9612 0.2175 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4084 0.9720 -1.0605 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8452 1.4043 -1.9360 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1965 2.0663 -0.3107 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 2 0
4 6 1 0
6 7 2 3
6 8 1 0
1 9 1 0
1 10 1 0
1 11 1 0
2 12 1 0
2 13 1 0
7 14 1 0
7 15 1 0
8 16 1 0
8 17 1 0
8 18 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers