Back to Search
N-(Methoxymethyl)-2-Methyl-2-Propenamide
CAS: 3644-12-0 | C6H11NO2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
3644-12-0
Molecular Formula:
C6H11NO2
Molecular Mass:
129.16 g/mol
Names and Synonyms:
N-(Methoxymethyl)-2-Methyl-2-Propenamide
2-Propenamide, N-(methoxymethyl)-2-methyl-
Acrylamide, N-(methoxymethyl)-2-methyl-
N-(Methoxymethyl)-2-methyl-2-propenamide
N-Methylolmethacrylamide methyl ether
Methoxymethylmethacrylamide
N-(Methoxymethyl)methacrylamide
N-Methoxymethylmethacrylamide
N-Methoxymethymethacrylamide
Identifiers:
SMILES:
C=C(C)C(O)=NCOC
InChI:
InChI=1S/C6H11NO2/c1-5(2)6(8)7-4-9-3/h1,4H2,2-3H3,(H,7,8)
Key Properties
Boiling Point
86 °C @ Press: 0.8 Torr
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 | 129.16 g/mol | CAS Common Chemistry |
| 129.15899999999996 g/mol | RDKit | |
| 129.078978592 g/mol | RDKit | |
| Boiling Point | 86 °C @ Press: 0.8 Torr | CAS Common Chemistry |
| Canonical SMILES | O=C(NCOC)C(=C)C | CAS Common Chemistry |
| InChI | InChI=1S/C6H11NO2/c1-5(2)6(8)7-4-9-3/h1,4H2,2-3H3,(H,7,8) | CAS Common Chemistry |
| InChI Key | InChIKey=YOZHLACIXDCHPV-UHFFFAOYSA-N | CAS Common Chemistry |
| Name | N-(Methoxymethyl)-2-methyl-2-propenamide | CAS Common Chemistry |
| Heavy Atom Count | 9 | RDKit |
| Hydrogen Bond Acceptors | 2 | RDKit |
| Hydrogen Bond Donors | 1 | RDKit |
| Rotatable Bonds | 3 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 41.82000000000001 Ų | RDKit |
| LogP | 1.1229 | RDKit |
| Molar Refractivity | 36.753800000000005 | RDKit |
