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
2.6915 0.0471 0.4865 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0101 -0.8896 -0.4848 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6172 -0.9423 -0.2195 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.1817 0.1859 -0.2817 C 0 0 0 0 0 0 0 0 0 0 0 0
0.3661 1.2704 -0.5828 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6018 0.0622 0.0017 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1335 -1.1015 0.3145 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4429 1.2945 -0.0720 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3363 0.7883 -0.0106 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9185 0.5880 1.0860 H 0 0 0 0 0 0 0 0 0 0 0 0
3.3336 -0.5277 1.1972 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1343 -0.4436 -1.5058 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3905 -1.9219 -0.4211 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4944 -1.9700 0.3579 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1787 -1.2513 0.5339 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.8515 2.0992 0.4048 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4766 1.5650 -1.1651 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.4371 1.1475 0.3607 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