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
-3.3793 0.1976 0.0614 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.3231 1.1458 0.5870 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.1144 0.8039 -0.0159 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.7712 -0.4942 0.2881 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5144 -0.7963 -0.3769 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5985 -1.7746 -1.2595 C 0 0 0 0 0 0 0 0 0 0 0 0
1.6707 0.0015 -0.0391 C 0 0 0 0 0 0 0 0 0 0 0 0
1.5572 0.9227 0.8026 O 0 0 0 0 0 0 0 0 0 0 0 0
2.9257 -0.2050 -0.6110 O 0 0 0 0 0 0 0 0 0 0 0 0
4.0125 0.6241 -0.2240 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.0883 -0.0703 -0.9720 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3839 -0.6986 0.7433 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3809 0.6736 0.1092 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5488 2.1966 0.2675 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.2644 1.1037 1.6992 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6314 -0.5309 1.4083 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5570 -1.2203 0.0037 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.2749 -2.3688 -1.5074 H 0 0 0 0 0 0 0 0 0 0 0 0
1.5078 -2.0303 -1.7668 H 0 0 0 0 0 0 0 0 0 0 0 0
3.9174 0.8733 0.8612 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0238 1.5612 -0.7980 H 0 0 0 0 0 0 0 0 0 0 0 0
4.9897 0.0853 -0.3241 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