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
-2.8039 -1.6260 -0.7867 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.1967 -0.6535 0.1814 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0209 -0.0631 -0.3323 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.5762 0.8083 0.6706 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6643 1.5158 0.2850 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6979 2.8333 0.2148 C 0 0 0 0 0 0 0 0 0 0 0 0
1.8533 0.7625 -0.0189 C 0 0 0 0 0 0 0 0 0 0 0 0
2.9027 1.3484 -0.3446 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8340 -0.6109 0.0498 O 0 0 0 0 0 0 0 0 0 0 0 0
2.9779 -1.3936 -0.2399 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9042 -1.5314 -0.7718 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4801 -2.6409 -0.5361 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4608 -1.3826 -1.8144 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.9480 -1.2014 1.1155 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8988 0.1876 0.3658 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4384 0.1850 1.5784 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.3873 1.5390 0.9410 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.1953 3.3904 0.4434 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5819 3.3894 -0.0624 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9583 -1.6700 -1.3148 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9433 -2.3460 0.3281 H 0 0 0 0 0 0 0 0 0 0 0 0
3.8969 -0.8402 0.0481 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