Monomers
Methyl 2-ethoxymethylacrylate
Identifiers
IUPAC name
methyl 2-(ethoxymethyl)prop-2-enoate
InchI
InChI=1S/C7H12O3/c1-4-10-5-6(2)7(8)9-3/h2,4-5H2,1,3H3
InchI Key
FKAHXBRRBLPYTM-UHFFFAOYSA-N
SMILES
CCOCC(=C)C(=O)OC
Canonical SMILES
CCOCC(=C)C(=O)OC
Isomeric SMILES
CCOCC(=C)C(=O)OC
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C7H12O3
Heavy Atom Count
10
Molecular Weight
144.17
Exact Molecular Weight
144.0786
Valence Electrons
58
Radical Electrons
0
tPSA
35.53
MolLogP
0.7521
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
22 21 0 0 0 0 0 0 0 0999 V2000
3.7607 -0.0169 -0.2333 C 0 0 0 0 0 0 0 0 0 0 0 0
2.3018 -0.2223 0.1444 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5825 -0.3836 -1.0078 O 0 0 0 0 0 0 0 0 0 0 0 0
0.2539 -0.5256 -0.7612 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.5140 0.6310 -0.3269 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.0404 1.8152 -0.1698 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.9549 0.4179 -0.0455 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6905 1.3625 0.3341 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.5606 -0.8212 -0.1847 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.9355 -1.0335 0.0817 C 0 0 0 0 0 0 0 0 0 0 0 0
4.4247 -0.3745 0.5834 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9031 1.0897 -0.3469 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9373 -0.4853 -1.1997 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2125 -1.1771 0.7465 H 0 0 0 0 0 0 0 0 0 0 0 0
2.0021 0.5794 0.8034 H 0 0 0 0 0 0 0 0 0 0 0 0
0.0659 -1.3346 0.0279 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2534 -0.9192 -1.6991 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6606 2.6736 0.1680 H 0 0 0 0 0 0 0 0 0 0 0 0
0.9764 2.0818 -0.3838 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2114 -1.9619 -0.4907 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0399 -1.1668 1.1621 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.5596 -0.2285 -0.3359 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 2 3
5 7 1 0
7 8 2 0
7 9 1 0
9 10 1 0
1 11 1 0
1 12 1 0
1 13 1 0
2 14 1 0
2 15 1 0
4 16 1 0
4 17 1 0
6 18 1 0
6 19 1 0
10 20 1 0
10 21 1 0
10 22 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers