Monomers
2-Acetoxyethyl methacrylate
Identifiers
IUPAC name
2-acetyloxyethyl 2-methylprop-2-enoate
InchI
InChI=1S/C8H12O4/c1-6(2)8(10)12-5-4-11-7(3)9/h1,4-5H2,2-3H3
InchI Key
ZTJNPDLOIVDEEL-UHFFFAOYSA-N
SMILES
CC(=O)OCCOC(=O)C(=C)C
Canonical SMILES
CC(=C)C(=O)OCCOC(=O)C
Isomeric SMILES
CC(=C)C(=O)OCCOC(=O)C
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C8H12O4
Heavy Atom Count
12
Molecular Weight
172.18
Exact Molecular Weight
172.0736
Valence Electrons
68
Radical Electrons
0
tPSA
52.6
MolLogP
0.6688
H Bond Acceptors
4
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
24 23 0 0 0 0 0 0 0 0999 V2000
3.3638 -1.7965 -0.8178 C 0 0 0 0 0 0 0 0 0 0 0 0
2.8044 -0.4175 -0.6347 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7697 0.3050 -1.6640 O 0 0 0 0 0 0 0 0 0 0 0 0
2.3502 0.0505 0.5791 O 0 0 0 0 0 0 0 0 0 0 0 0
1.8212 1.3455 0.7634 C 0 0 0 0 0 0 0 0 0 0 0 0
0.6032 1.6250 -0.0646 C 0 0 0 0 0 0 0 0 0 0 0 0
-0.4575 0.7052 0.2487 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.6772 0.7856 -0.4030 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8040 1.6887 -1.2663 O 0 0 0 0 0 0 0 0 0 0 0 0
-2.7830 -0.1311 -0.1141 C 0 0 0 0 0 0 0 0 0 0 0 0
-3.9082 -0.0069 -0.7598 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.6330 -1.1924 0.9007 C 0 0 0 0 0 0 0 0 0 0 0 0
2.5859 -2.4614 -1.2355 H 0 0 0 0 0 0 0 0 0 0 0 0
4.2355 -1.7390 -1.5247 H 0 0 0 0 0 0 0 0 0 0 0 0
3.7101 -2.2120 0.1461 H 0 0 0 0 0 0 0 0 0 0 0 0
2.5984 2.0909 0.4337 H 0 0 0 0 0 0 0 0 0 0 0 0
1.6581 1.5359 1.8308 H 0 0 0 0 0 0 0 0 0 0 0 0
0.8139 1.4485 -1.1383 H 0 0 0 0 0 0 0 0 0 0 0 0
0.2640 2.6554 0.0988 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.0370 0.7608 -1.5035 H 0 0 0 0 0 0 0 0 0 0 0 0
-4.7395 -0.6638 -0.5712 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.6097 -0.7299 1.8964 H 0 0 0 0 0 0 0 0 0 0 0 0
-3.3286 -2.0210 0.7853 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6008 -1.6255 0.7458 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 2 0
2 4 1 0
4 5 1 0
5 6 1 0
6 7 1 0
7 8 1 0
8 9 2 0
8 10 1 0
10 11 2 3
10 12 1 0
1 13 1 0
1 14 1 0
1 15 1 0
5 16 1 0
5 17 1 0
6 18 1 0
6 19 1 0
11 20 1 0
11 21 1 0
12 22 1 0
12 23 1 0
12 24 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers