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Sodium Methacrylate
CAS: 5536-61-8 | C4H6NaO2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
5536-61-8
Molecular Formula:
C4H6NaO2
Molecular Mass:
109.08 g/mol
Names and Synonyms:
Sodium Methacrylate
2-Propenoic acid, 2-methyl-, sodium salt (1:1)
Methacrylic acid, sodium salt
2-Propenoic acid, 2-methyl-, sodium salt
Sodium methacrylate
Identifiers:
SMILES:
C=C(C)C(=O)O.[Na]
InChI:
InChI=1S/C4H6O2.Na/c1-3(2)4(5)6;/h1H2,2H3,(H,5,6);
Key Properties
Melting Point
310 °C
CAS Common Chemistry
Density
2.70 g/cm³
CAS Common Chemistry
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
| Property | Value | Source |
|---|---|---|
| Molecular Mass | 109.08 g/mol | CAS Common Chemistry |
| 109.07999999999997 g/mol | RDKit | |
| 109.02654871200001 g/mol | RDKit | |
| Density | 2.70 g/cm³ | CAS Common Chemistry |
| 2.703 g/cm3 | CAS Common Chemistry | |
| Canonical SMILES | [Na].O=C(O)C(=C)C | CAS Common Chemistry |
| InChI | InChI=1S/C4H6O2.Na/c1-3(2)4(5)6;/h1H2,2H3,(H,5,6); | CAS Common Chemistry |
| InChI Key | InChIKey=PBCKVROHSSNSDY-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 310 °C | CAS Common Chemistry |
| Name | Sodium methacrylate | CAS Common Chemistry |
| Heavy Atom Count | 7 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 1 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 37.3 Ų | RDKit |
| LogP | 0.2662999999999999 | RDKit |
| Molar Refractivity | 28.20379999999999 | RDKit |
