2-(Dimethylamino)ethanolCAS# 108-01-0 |
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Chemical structure
3D structure
| Cas No. | 108-01-0 | SDF | Download SDF |
| PubChem ID | 7902 | Appearance | Oil |
| Formula | C4H11NO | M.Wt | 89.14 |
| Type of Compound | Alkaloids | Storage | Desiccate at -20°C |
| Solubility | Soluble in Chloroform,Dichloromethane,Ethyl Acetate,DMSO,Acetone,etc. | ||
| Chemical Name | 2-(dimethylamino)ethanol | ||
| SMILES | CN(C)CCO | ||
| Standard InChIKey | UEEJHVSXFDXPFK-UHFFFAOYSA-N | ||
| General tips | For obtaining a higher solubility , please warm the tube at 37 ℃ and shake it in the ultrasonic bath for a while.Stock solution can be stored below -20℃ for several months. We recommend that you prepare and use the solution on the same day. However, if the test schedule requires, the stock solutions can be prepared in advance, and the stock solution must be sealed and stored below -20℃. In general, the stock solution can be kept for several months. Before use, we recommend that you leave the vial at room temperature for at least an hour before opening it. |
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| About Packaging | 1. The packaging of the product may be reversed during transportation, cause the high purity compounds to adhere to the neck or cap of the vial.Take the vail out of its packaging and shake gently until the compounds fall to the bottom of the vial. 2. For liquid products, please centrifuge at 500xg to gather the liquid to the bottom of the vial. 3. Try to avoid loss or contamination during the experiment. |
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| Shipping Condition | Packaging according to customer requirements(5mg, 10mg, 20mg and more). Ship via FedEx, DHL, UPS, EMS or other couriers with RT, or blue ice upon request. | ||
The Neurospora crassa
| Description | 1. 2-(Dimethylamino)ethanol is a CNS stimulant, has antidepressant activity. |
| Targets | Androgen Receptor |
2-(Dimethylamino)ethanol Dilution Calculator
2-(Dimethylamino)ethanol Molarity Calculator
| 1 mg | 5 mg | 10 mg | 20 mg | 25 mg | |
| 1 mM | 11.2183 mL | 56.0915 mL | 112.1831 mL | 224.3662 mL | 280.4577 mL |
| 5 mM | 2.2437 mL | 11.2183 mL | 22.4366 mL | 44.8732 mL | 56.0915 mL |
| 10 mM | 1.1218 mL | 5.6092 mL | 11.2183 mL | 22.4366 mL | 28.0458 mL |
| 50 mM | 0.2244 mL | 1.1218 mL | 2.2437 mL | 4.4873 mL | 5.6092 mL |
| 100 mM | 0.1122 mL | 0.5609 mL | 1.1218 mL | 2.2437 mL | 2.8046 mL |
| * Note: If you are in the process of experiment, it's necessary to make the dilution ratios of the samples. The dilution data above is only for reference. Normally, it's can get a better solubility within lower of Concentrations. | |||||
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Molecular dynamics simulations of 2-(dimethylamino)ethanol (DMEA).[Pubmed:25799889]
J Phys Chem B. 2015 Apr 16;119(15):5035-46.
We develop a multipurpose force field to investigate the properties of the condensed phases of 2-(Dimethylamino)ethanol (DMEA). We use ab initio computations at the HF/6-311++G(2d,2p) level to derive partial charges, obtain force constants, and compute the electrostatic potential of the DMEA. We find that the HF predictions for the dipole moment are in excellent agreement with the experimental result (2.6 D). The computations also show the strong preference of DMEA to form intramolecular hydrogen bonds between the hydrogen in the alcohol group and nitrogen. We have tested the accuracy of our force field by computing coexistence and interfacial properties as well as thermal conductivities in wide range of thermodynamic states. In all these instances we find excellent agreement with the available experimental data. We have further investigated the structure of the liquid by computing pair correlations. Our results indicate a clear preference for DMEA to form low-dimensional structures, such as linear and bifurcated chains, which are driven by the association of the DMEA molecules via the alcohol group. Overall, our force field provides a good basis to compute the bulk and interfacial properties of DMEA.
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