Monomers
Ethyl 2-ethoxyprop-2-enoate
Identifiers
IUPAC name
ethyl 2-ethoxyprop-2-enoate
InchI
InChI=1S/C7H12O3/c1-4-9-6(3)7(8)10-5-2/h3-5H2,1-2H3
InchI Key
WXMSGMOIAQWILS-UHFFFAOYSA-N
SMILES
CCOC(=O)C(=C)OCC
Canonical SMILES
CCOC(=C)C(=O)OCC
Isomeric SMILES
CCOC(=C)C(=O)OCC
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
1.0997
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
-3.5884 -0.8162 -0.6502 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6594 0.3834 -0.4335 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4636 -0.1198 0.0690 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.3575 0.6277 0.4014 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4048 1.8694 0.2481 O 0 0 0 0 0 0 0 0 0 0 0 0
0.7972 -0.0859 0.9115 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7946 -1.3947 1.0534 C 0 0 0 0 0 0 0 0 0 0 0 0
1.9075 0.6828 1.2430 O 0 0 0 0 0 0 0 0 0 0 0 0
2.5912 1.2293 0.1269 C 0 0 0 0 0 0 0 0 0 0 0 0
3.0443 0.0513 -0.7112 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.4035 -0.5914 -1.3413 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.0133 -1.6890 -1.0252 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.9377 -1.0981 0.3697 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.1218 1.0174 0.3518 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5467 0.9704 -1.3611 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.0491 -1.9887 0.8025 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6676 -1.9048 1.4358 H 0 0 0 0 0 0 0 0 0 0 0 0
1.8208 1.7782 -0.4606 H 0 0 0 0 0 0 0 0 0 0 0 0
3.4354 1.8747 0.4270 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1878 -0.8675 -0.1046 H 0 0 0 0 0 0 0 0 0 0 0 0
2.2724 -0.2139 -1.4872 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0271 0.2853 -1.1679 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
8 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
7 16 1 0
7 17 1 0
9 18 1 0
9 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