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
3.4805 -0.1399 1.2249 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5703 0.4895 0.2101 C 0 0 0 0 0 0 0 0 0 0 0 0
1.3307 -0.1840 0.1239 O 0 0 0 0 0 0 0 0 0 0 0 0
0.6305 0.5440 -0.8632 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.6964 0.0235 -1.1252 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.0324 -0.3996 -2.3175 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6711 -0.0328 -0.0570 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4242 0.3565 1.1218 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.9468 -0.5266 -0.2833 O 0 0 0 0 0 0 0 0 0 0 0 0
-3.9246 -0.5932 0.7488 C 0 0 0 0 0 0 0 0 0 0 0 0
4.2402 0.6433 1.5146 H 0 0 0 0 0 0 0 0 0 0 0 0
4.0613 -0.9905 0.8428 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9084 -0.3533 2.1448 H 0 0 0 0 0 0 0 0 0 0 0 0
2.4108 1.5371 0.4730 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9854 0.4613 -0.8187 H 0 0 0 0 0 0 0 0 0 0 0 0
0.6141 1.5962 -0.4666 H 0 0 0 0 0 0 0 0 0 0 0 0
1.2571 0.4723 -1.7745 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3169 -0.3646 -3.1260 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.0171 -0.8013 -2.5717 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0056 -1.6200 1.1595 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.5768 0.0762 1.5756 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.8774 -0.1942 0.3930 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