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
2.7615 -0.2533 -0.0456 C 0 0 0 0 0 0 0 0 0 0 0 0
1.4030 -0.6226 -0.1273 O 0 0 0 0 0 0 0 0 0 0 0 0
0.3967 0.2858 0.1219 C 0 0 0 0 0 0 0 0 0 0 0 0
0.7191 1.4490 0.4231 O 0 0 0 0 0 0 0 0 0 0 0 0
-1.0084 -0.0915 0.0386 C 0 0 0 0 0 0 0 0 0 0 0 0
-1.4211 -1.2886 -0.2705 C 0 0 0 0 0 0 0 0 0 0 0 0
-2.0545 0.9388 0.3202 C 0 0 0 0 0 0 0 0 0 0 0 0
3.3520 -0.8951 0.6254 H 0 0 0 0 0 0 0 0 0 0 0 0
3.1853 -0.2981 -1.0806 H 0 0 0 0 0 0 0 0 0 0 0 0
2.8187 0.8054 0.3157 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4603 -1.5207 -0.3198 H 0 0 0 0 0 0 0 0 0 0 0 0
-0.7029 -2.0572 -0.4799 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.4204 0.7678 1.3389 H 0 0 0 0 0 0 0 0 0 0 0 0
-2.8855 0.8196 -0.4281 H 0 0 0 0 0 0 0 0 0 0 0 0
-1.6831 1.9609 0.2207 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