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Methacrylamide
CAS: 79-39-0 | C4H7NO
2D Structure
3D Structure
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Basic Information
CAS Registry Number:
79-39-0
Molecular Formula:
C4H7NO
Molecular Mass:
85.11 g/mol
Names and Synonyms:
Methacrylamide
2-Propenamide, 2-methyl-
Methacrylamide
2-Methyl-2-propenamide
Methacrylic acid amide
Methacrylic amide
2-Methylpropenamide
2-Methylacrylamide
NSC 23772
NSC 24147
Identifiers:
SMILES:
C=C(C)C(=N)O
InChI:
InChI=1S/C4H7NO/c1-3(2)4(5)6/h1H2,2H3,(H2,5,6)
Key Properties
Melting Point
105 °C
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 | 85.11 g/mol | CAS Common Chemistry |
| 85.10599999999998 g/mol | RDKit | |
| 85.052763844 g/mol | RDKit | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Methacrylamide | CAS Common Chemistry |
| Canonical SMILES | O=C(N)C(=C)C | CAS Common Chemistry |
| InChI | InChI=1S/C4H7NO/c1-3(2)4(5)6/h1H2,2H3,(H2,5,6) | CAS Common Chemistry |
| InChI Key | InChIKey=FQPSGWSUVKBHSU-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 105 °C | CAS Common Chemistry |
| Name | Methacrylamide | CAS Common Chemistry |
| Heavy Atom Count | 6 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 2 | RDKit |
| Rotatable Bonds | 1 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 44.08 Ų | RDKit |
| LogP | 1.09777 | RDKit |
| Molar Refractivity | 25.169499999999992 | RDKit |
