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
-4.0492 -0.2721 -0.2012 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.7121 0.3327 -0.5397 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.6547 -0.3164 0.0855 O 0 0 0 0 0 0 0 0 0 0 0 0
-0.4906 0.3523 -0.3218 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7176 -0.2430 0.2769 C 0 0 0 0 0 0 0 0 0 0 0 0
0.5991 -1.2683 1.0765 C 0 0 0 0 0 0 0 0 0 0 0 0
2.0048 0.3281 -0.0403 C 0 0 0 0 0 0 0 0 0 0 0 0
2.1650 1.3132 -0.8037 O 0 0 0 0 0 0 0 0 0 0 0 0
3.1466 -0.2332 0.5243 O 0 0 0 0 0 0 0 0 0 0 0 0
4.4507 0.2477 0.2804 C 0 0 0 0 0 0 0 0 0 0 0 0
-4.7725 0.1178 -0.9660 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.3912 0.1528 0.7653 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0708 -1.3609 -0.2258 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6893 1.3831 -0.2674 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.5641 0.1598 -1.6439 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.6311 1.4161 -0.0367 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.4822 0.2564 -1.4444 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.3690 -1.6788 1.2999 H 0 0 0 0 0 0 0 0 0 0 0 0
1.4971 -1.7054 1.5172 H 0 0 0 0 0 0 0 0 0 0 0 0
5.0587 -0.6431 -0.0319 H 0 0 0 0 0 0 0 0 0 0 0 0
4.4112 0.9902 -0.5382 H 0 0 0 0 0 0 0 0 0 0 0 0
4.8258 0.6710 1.2353 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