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
2.9544 0.0821 0.6126 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9850 -0.3664 -0.4619 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6850 -0.0568 -0.0182 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4595 -0.3253 -0.7470 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.2840 -0.8781 -1.8640 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.7700 0.0203 -0.2305 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8660 -0.2396 -0.9339 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8663 0.6702 1.0995 C 0 0 0 0 0 0 0 0 0 0 0 0
3.8761 -0.5312 0.6211 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1873 1.1576 0.3819 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4377 0.0787 1.5812 H 0 0 0 0 0 0 0 0 0 0 0 0
2.1262 -1.4744 -0.5631 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2285 0.0809 -1.4444 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.8316 0.0287 -0.5250 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7703 -0.7147 -1.9023 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.2991 1.6303 1.1245 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9316 0.7996 1.3632 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4019 0.0379 1.9064 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