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| CAS No.: | 53170-19-7 |
|---|---|
| Name: | DIMETHYL-D 6-AMINE HYDROCHLORIDE |
| Article Data: | 7 |
| Molecular Structure: | |
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|
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| Formula: | C2H2ClD6N |
| Molecular Weight: | 87.4976 |
| Synonyms: | Di(trideuteromethyl)ammoniumchloride;Methan-d3-amine, N-(methyl-d3)-, hydrochloride; |
| EINECS: | 258-409-7 |
| Melting Point: | 170-173 °C (lit.) |
| Boiling Point: | 47 °C at 760 mmHg |
| Hazard Symbols: |
 Xn,  Xi
|
| Risk Codes: | 22-36/37/38 |
| Safety: | 26-36 |
| PSA: | 12.03000 |
| LogP: | 1.02850 |
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- Total:16 Page 1 of 1 1
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Specification
The Dimethyl-d6-amine hydrochloride, with the CAS registry number 53170-19-7, is also known as Methan-d3-amine, N-(methyl-d3)-, hydrochloride. It belongs to the product categories of Alphabetical Listings; D; Stable Isotopes. Its EINECS registry number is 258-409-7. This chemical's molecular formula is C2H2ClD6N and molecular weight is 87.58. What's more, its IUPAC name is 1, 1, 1-Trideuterio-N-(trideuteriomethyl)methanamine hydrochloride. In addition, it must be stored in airtight containers and placed in a dry, cool place.
Physical properties about Dimethyl-d6-amine hydrochloride are: (1)# of Rule of 5 Violations: 0; (2)#H bond acceptors: 1; (3)#H bond donors: 1; (4)#Freely Rotating Bonds: 0; (5)Polar Surface Area: Å2; (6)Enthalpy of Vaporization: 29.68 kJ/mol; (7)Boiling Point: 47 °C at 760 mmHg; (8)Vapour Pressure: 322 mmHg at 25 °C.
Uses of Dimethyl-d6-amine hydrochloride: it is used to produce other chemicals. For example, it is used to produce N, N-Bis-trideuteriomethyl-benzamide. The reaction needs reagent aq. NaOH and solvent Tetrahydrofuran. The reaction time is 6 hours with reaction temperature of 25 °C. The yield is about 80 %.
When you are using this chemical, please be cautious about it as the following:
As a chemical, it is irritating to eyes, respiratory system and skin. And it is harmful if swallowed. In addition, this chemical may cause inflammation to the skin or other mucous membranes. During using it, wear suitable protective clothing. In case of contact with eyes, rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1) SMILES: Cl.[2H]C([2H])([2H])NC([2H])([2H])[2H]
(2) InChI: InChI=1/C2H7N.ClH/c1-3-2;/h3H,1-2H3;1H/i1D3,2D3;
(3) InChIKey: IQDGSYLLQPDQDV-TXHXQZCNEG