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
-3.3066 0.7914 0.7649 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.4153 1.2207 -0.3533 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0773 1.0176 -0.1132 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.8587 -0.3448 0.0976 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5740 -0.6281 0.3633 C 0 0 0 0 0 0 0 0 0 0 0 0
0.9162 -1.1833 1.5042 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6189 -0.3106 -0.6011 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2964 0.2190 -1.6903 O 0 0 0 0 0 0 0 0 0 0 0 0
2.9200 -0.5853 -0.3213 O 0 0 0 0 0 0 0 0 0 0 0 0
4.0022 -0.3079 -1.2063 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.8892 1.0440 1.7642 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.2651 1.3793 0.6789 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.6190 -0.2738 0.6892 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.7378 0.6890 -1.2811 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6059 2.3091 -0.5466 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.1743 -0.9323 -0.7775 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.4288 -0.6158 1.0054 H 0 0 0 0 0 0 0 0 0 0 0 0
0.1484 -1.4206 2.2218 H 0 0 0 0 0 0 0 0 0 0 0 0
1.9514 -1.3971 1.7162 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8923 -0.1325 -0.5637 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2169 -1.1685 -1.8636 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8415 0.6305 -1.7772 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