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
2.7471 -0.4657 0.3817 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0886 0.8758 0.2275 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7755 0.7930 -0.2876 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.2481 0.1022 0.3410 C 0 0 0 0 0 0 0 0 0 0 0 0
0.0560 -0.4727 1.4373 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.5931 0.0009 -0.1596 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8874 0.6046 -1.2983 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6406 -0.7581 0.5691 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5928 -0.9296 1.3659 H 0 0 0 0 0 0 0 0 0 0 0 0
2.3627 -1.1519 -0.4009 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8536 -0.2962 0.2767 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0789 1.4074 1.2213 H 0 0 0 0 0 0 0 0 0 0 0 0
2.6761 1.4750 -0.5173 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9034 0.5432 -1.7013 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1348 1.1601 -1.8386 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7843 -0.3747 1.6005 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4267 -1.8527 0.6021 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6130 -0.6606 0.0327 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