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Dimethylformamide
CAS: 68-12-2 | C3H7NO
2D Structure
3D Structure
Loading 3D structure...
Basic Information
CAS Registry Number:
68-12-2
Molecular Formula:
C3H7NO
Molecular Mass:
73.10 g/mol
Names and Synonyms:
Dimethylformamide
Formamide, N,N-dimethyl-
N,N-Dimethylformamide
Dimethylformamide
DMF
N-Formyldimethylamine
DMFA
DMF (amide)
N,N-Dimethylmethanamide
N,N-Dimethylformaldehyde
Virodene-P 058
NSC 5356
D 165635
Identifiers:
SMILES:
CN(C)C=O
InChI:
InChI=1S/C3H7NO/c1-4(2)3-5/h3H,1-2H3
Key Properties
Boiling Point
153 °C @ Press: 760 Torr
CAS Common Chemistry
Melting Point
-61 °C
CAS Common Chemistry
Density
0.94 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 | 73.10 g/mol | CAS Common Chemistry |
| 73.095 g/mol | RDKit | |
| 73.052763844 g/mol | RDKit | |
| Density | 0.94 g/cm³ | CAS Common Chemistry |
| 0.9445 g/cm3 @ Temp: 25 °C | CAS Common Chemistry | |
| Wikipedia Url | https://en.wikipedia.org/wiki/Dimethylformamide | CAS Common Chemistry |
| Boiling Point | 153 °C @ Press: 760 Torr | CAS Common Chemistry |
| Canonical SMILES | O=CN(C)C | CAS Common Chemistry |
| InChI | InChI=1S/C3H7NO/c1-4(2)3-5/h3H,1-2H3 | CAS Common Chemistry |
| InChI Key | InChIKey=ZMXDDKWLCZADIW-UHFFFAOYSA-N | CAS Common Chemistry |
| Melting Point | -61 °C | CAS Common Chemistry |
| Name | Dimethylformamide | CAS Common Chemistry |
| Heavy Atom Count | 5 | RDKit |
| Hydrogen Bond Acceptors | 1 | RDKit |
| Hydrogen Bond Donors | 0 | RDKit |
| Rotatable Bonds | 1 | RDKit |
| Aromatic Ring Count | 0 | RDKit |
| Topological Polar Surface Area | 20.310000000000002 Ų | RDKit |
| LogP | -0.2956000000000001 | RDKit |
| Molar Refractivity | 19.750999999999998 | RDKit |
