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Dimethylformamide Dimethyl Acetal
CAS: 4637-24-5 | C5H13NO2
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
4637-24-5
Molecular Formula:
C5H13NO2
Molecular Mass:
119.16 g/mol
Names and Synonyms:
Dimethylformamide Dimethyl Acetal
Methanamine, 1,1-dimethoxy-N,N-dimethyl-
Trimethylamine, 1,1-dimethoxy-
1,1-Dimethoxy-N,N-dimethylmethanamine
1,1-Dimethoxytrimethylamine
N-(Dimethoxymethyl)dimethylamine
Dimethoxy(dimethylamino)methane
Methyl-8
(Dimethylamino)formaldehyde dimethyl acetal
(Dimethylamino)dimethoxymethane
Dimethoxy-N,N-dimethylmethylamine
DMF dimethyl acetal
N,N-Dimethylformamide dimethyl acetal
Dimethylformamide dimethyl acetal
α,α-Dimethoxytrimethylamine
DMFDMA
N-(Dimethoxymethyl)-N,N-dimethylamine
(Dimethoxymethyl)dimethylamine
Dimethoxy-N,N-dimethylmethanamine
Dimethyl dimethylformamide acetal
N,N-Dimethyl-1,1-bis(methyloxy)methanamine
N,N-Dimethyl(dimethoxymethyl)amine
N,N-Dimethylformamido dimethyl acetal
Identifiers:
SMILES:
COC(OC)N(C)C
InChI:
InChI=1S/C5H13NO2/c1-6(2)5(7-3)8-4/h5H,1-4H3
Key Properties
Boiling Point
107-108 °C @ Press: 763 Torr
CAS Common Chemistry
Melting Point
101-102 °C
CAS Common Chemistry
Density
0.90 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 | 119.16 g/mol | CAS Common Chemistry |
| 119.164 g/mol | RDKit | |
| 119.094628656 g/mol | RDKit | |
| Density | 0.90 g/cm³ | CAS Common Chemistry |
| 0.8990 g/cm3 @ Temp: 20 °C | CAS Common Chemistry | |
| Boiling Point | 107-108 °C @ Press: 763 Torr | CAS Common Chemistry |
| Canonical SMILES | O(C)C(OC)N(C)C | CAS Common Chemistry |
| InChI | InChI=1S/C5H13NO2/c1-6(2)5(7-3)8-4/h5H,1-4H3 | CAS Common Chemistry |
| InChI Key | InChIKey=ZSXGLVDWWRXATF-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | 101-102 °C | CAS Common Chemistry |
| Name | Dimethylformamide dimethyl acetal | CAS Common Chemistry |
| Heavy Atom Count | 8 | RDKit |
| Hydrogen Bond Acceptors | 3 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 3 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 21.700000000000003 Ų | RDKit |
| LogP | 0.12439999999999984 | RDKit |
| Molar Refractivity | 31.492999999999984 | RDKit |
