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Methyl Methacrylate
CAS: 80-62-6 | C5H8O2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
80-62-6
Molecular Formula:
C5H8O2
Molecular Weight:
100.11699999999998 g/mol
Names and Synonyms:
Methyl Methacrylate
Acrifix 1S0116
Visiomer MMA
Degacryl M 547
DL 101
ACR-PA 20
Acryester MMA
Methyl isobutenoate
Three Bond 3057J
Methyl 2-methacrylate
Paraloid HT 100
Acryloid HT 100
Methyl methacrylate
NSC 4769
Light Ester M
2-Methyl-2-propenoic acid methyl ester
TEB 3K
Acryester M
2-(Methoxycarbonyl)-1-propene
Methyl 2-methylacrylate
Pegalan
Methyl 2-methyl-2-propenoate
MMA
Methacrylic acid, methyl ester
Methacrylic acid methyl ester
2-Propenoic acid, 2-methyl-, methyl ester
Identifiers:
SMILES:
C=C(C)C(=O)OC
InChI:
InChI=1S/C5H8O2/c1-4(2)5(6)7-3/h1H2,2-3H3
Spectral Data
NMR, IR, and Mass spectral data
1H NMR
13C NMR
Predicting NMR spectra...
10 ppm
9
8
7
6
5
4
3
2
1
0 ppm
| Shift (ppm) | Multiplicity | Integration | Assignment |
|---|
200 ppm
180
160
140
120
100
80
60
40
20
0 ppm
| Shift (ppm) | DEPT | Assignment |
|---|
Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.
All Properties
Comprehensive physical and chemical properties
Physical Properties
| Property | Value | Source |
|---|---|---|
| molecular_mass | 100.12 g/mol | Legacy Database |
| density | 0.94 g/cm³ | Legacy Database |
| wikipedia_url | https://en.wikipedia.org/wiki/Methyl_methacrylate None | Legacy Database |
| cas-boiling-point | 100.5 °C @ Press: 760 Torr None | Legacy Database |
| cas-canonical-smile | O=C(OC)C(=C)C None | Legacy Database |
| cas-density | 0.9440 g/cm3 @ Temp: 20 °C None | Legacy Database |
| cas-inchi | InChI=1S/C5H8O2/c1-4(2)5(6)7-3/h1H2,2-3H3 None | Legacy Database |
| cas-inchi-key | InChIKey=VVQNEPGJFQJSBK-UHFFFAOYSA-N None | Legacy Database |
| cas-melting-point | -48 °C None | Legacy Database |
| cas-name | 2-Propenoic acid, 2-methyl-, methyl ester None | Legacy Database |
| wikipedia-name | Methyl methacrylate None | Legacy Database |
| LogP | 0.7355 | RDKit |
Molecular
| Property | Value | Source |
|---|---|---|
| Molecular Weight | 100.11699999999998 g/mol | RDKit |
Exact
| Property | Value | Source |
|---|---|---|
| Exact Molecular Weight | 100.052429496 g/mol | RDKit |
Heavy
| Property | Value | Source |
|---|---|---|
| Heavy Atom Count | 7 count | RDKit |
Hydrogen
| Property | Value | Source |
|---|---|---|
| Hydrogen Bond Acceptors | 2 count | RDKit |
| Hydrogen Bond Donors | 0 count | RDKit |
Rotatable
| Property | Value | Source |
|---|---|---|
| Rotatable Bonds | 1 count | RDKit |
Aromatic
| Property | Value | Source |
|---|---|---|
| Aromatic Ring Count | 0 count | RDKit |
Topological
| Property | Value | Source |
|---|---|---|
| Topological Polar Surface Area | 26.3 Ų | RDKit |
Molar
| Property | Value | Source |
|---|---|---|
| Molar Refractivity | 26.829999999999988 | RDKit |
