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| CAS No.: | 120092-66-2 |
|---|---|
| Name: | DIETHYL-D10-AMINE |
| Molecular Structure: | |
|
|
|
| Formula: | C4HD10N |
| Molecular Weight: | 83.1985 |
| Synonyms: | 1,1,2,2,2-Pentadeuterio-N-(1,1,2,2,2-pentadeuterioethyl)ethanamine; |
| Density: | 0.804 g/cm3 |
| Melting Point: | -50 °C(lit.) |
| Boiling Point: | 57.3 °C at 760 mmHg |
| Flash Point: | −20 °F |
| Hazard Symbols: |
 F+, C
|
| Risk Codes: | 12-34-42/43 |
| Safety: | 16-26-36 |
| Transport Information: | UN 1154 3/PG 2 |
| PSA: | 12.03000 |
| LogP: | 1.00670 |
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Specification
The Ethan-d5-amine,N-(ethyl-d5)- (9CI), with the CAS registry number 120092-66-2, is also known as N-(2H5)Ethyl(2H5)ethanamine. It belongs to the product categories of Alphabetical Listings; D; Stable Isotopes. This chemical's molecular formula is C4HD10N and molecular weight is 83.1985. What's more, its systematic name is 1,1,2,2,2-Pentadeuterio-N-(1,1,2,2,2-pentadeuterioethyl)ethanamine.
Physical properties about Ethan-d5-amine,N-(ethyl-d5)- (9CI) are: (1)ACD/LogP: 0.63; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 12.03 Å2; (7)Index of Refraction: 1.384; (8)Molar Refractivity: 24.17 cm3; (9)Molar Volume: 103.3 cm3; (10)Polarizability: 9.58×10-24 cm3; (11)Surface Tension: 20.2 dyne/cm; (12)Density: 0.804 g/cm3; (13)Enthalpy of Vaporization: 29.06 kJ/mol; (14)Boiling Point: 57.3 °C at 760 mmHg; (15)Vapour Pressure: 218 mmHg at 25 °C.
When you are dealing with this chemical, you should be very careful. This chemical is extremely flammable and it may cause sensitisation by inhalation and skin contact. Therefore, you should keep it away from sources of ignition. In addition, you should wear suitable protective clothing. In case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice.
You can still convert the following datas into molecular structure:
(1) SMILES: [2H]C([2H])(NC([2H])([2H])C([2H])([2H])[2H])C([2H])([2H])[2H]
(2) InChI: InChI=1/C4H11N/c1-3-5-4-2/h5H,3-4H2,1-2H3/i1D3,2D3,3D2,4D2
(3) InChIKey: HPNMFZURTQLUMO-MWUKXHIBEM