Monomers
Methyl methacrylate
Identifiers
IUPAC name
methyl 2-methylprop-2-enoate
InchI
InChI=1S/C5H8O2/c1-4(2)5(6)7-3/h1H2,2-3H3
InchI Key
VVQNEPGJFQJSBK-UHFFFAOYSA-N
SMILES
COC(=O)C(=C)C
Canonical SMILES
CC(=C)C(=O)OC
Isomeric SMILES
CC(=C)C(=O)OC
Structures
2D Structure
3D Structure
Molecular Formula and Computed Descriptors
Molecular Formula
C5H8O2
Heavy Atom Count
7
Molecular Weight
100.117
Exact Molecular Weight
100.0524
Valence Electrons
40
Radical Electrons
0
tPSA
26.3
MolLogP
0.7355
H Bond Acceptors
2
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
15 14 0 0 0 0 0 0 0 0999 V2000
2.6234 -0.1944 -0.3632 C 0 0 0 0 0 0 0 0 0 0 0 0
1.2484 -0.5022 -0.2196 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3694 0.5137 0.0723 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7959 1.6738 0.2034 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0307 0.2267 0.2228 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.8784 1.1949 0.5023 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.5526 -1.1517 0.0692 C 0 0 0 0 0 0 0 0 0 0 0 0
2.7683 0.4227 -1.2603 H 0 0 0 0 0 0 0 0 0 0 0 0
2.9866 0.3268 0.5593 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1848 -1.1538 -0.4374 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.9426 1.0539 0.6295 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.5331 2.2270 0.6238 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.8013 -1.9121 0.3798 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.7932 -1.3819 -1.0003 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4449 -1.3434 0.7171 H 0 0 0 0 0 0 0 0 0 0 0 0
1 2 1 0
2 3 1 0
3 4 2 0
3 5 1 0
5 6 2 3
5 7 1 0
1 8 1 0
1 9 1 0
1 10 1 0
6 11 1 0
6 12 1 0
7 13 1 0
7 14 1 0
7 15 1 0
M END
Similar Monomers
Structure
Similarity
IUPAC name
MF
Copolymers