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Methan-d3-amine,N,N-di(methyl-d3)- (9CI)

  • Name Methan-d3-amine,N,N-di(methyl-d3)- (9CI)
  • EINECSN/A
  • CAS No. 13960-80-0
  • Density0.799 g/cm3
  • PSA3.24000
  • LogP0.17780
  • SolubilityN/A
  • Melting Point117 °C(lit.)
  • FormulaC3D9N
  • Boiling Point2.8 °C at 760 mmHg
  • Molecular Weight68.0397
  • Flash Point20 °F
  • Transport InformationUN 1083
  • AppearanceN/A
  • Safety16-26-29-36
  • Risk Codes12-20-37/38-41-36/37/38
  • Molecular Structure
    Molecular Structure of 13960-80-0 (TRIMETHYL-D9-AMINE)
  • Hazard SymbolsHighlyF+;IrritantXi;HarmfulXn
  • SynonymsHighlyF+;IrritantXi;HarmfulXn
  • Article Data5

Methan-d3-amine,N,N-di(methyl-d3)- (9CI) Specification

The Methan-d3-amine,N,N-di(methyl-d3)- (9CI), with the CAS registry number of 13960-80-0, is also known as Trimethyl-d9-ammonium-15N chloride. It belongs to the product categories of Alphabetical Listings; Chemical Synthesis; Compressed and Liquefied GasesStable Isotopes; GasesStable Isotopes; Synthetic Reagents. Its molecular formula is C3D9N and molecular weight is 68.17. What's more, its systematic name is N,N-Bis[(2H3)methyl](2H3)methanamine.

Physical properties about the Methan-d3-amine,N,N-di(methyl-d3)- (9CI) are: (1)ACD/LogP: 0.06; (2)# of Rule of 5 Violations: 0 ; (3)ACD/BCF (pH 5.5): 1; (4)ACD/BCF (pH 7.4): 1; (5)ACD/KOC (pH 5.5): 1; (6)ACD/KOC (pH 7.4): 1; (7)#H bond acceptors: 1; (8)#H bond donors: 0; (9)#Freely Rotating Bonds: 0; (10)Polar Surface Area: Å2; (11)Index of Refraction: 1.378; (12)Molar Refractivity: 19.66 cm3; (13)Molar Volume: 85.3 cm3; (14)Surface Tension: 18.6 dyne/cm; (15)Density: 0.799 g/cm3; (16)Enthalpy of Vaporization: 22.94 kJ/mol; (17)Boiling Point: 2.8 °C at 760 mmHg; (18)Vapour Pressure: 1720 mmHg at 25 °C.

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. If contact with eyes accidently, rinse immediately with plenty of water and seek medical advice. In addition, during using it, wear suitable protective clothing.

You can still convert the following datas into molecular structure:
(1) SMILES: [2H]C([2H])([2H])N(C([2H])([2H])[2H])C([2H])([2H])[2H]
(2) InChI: InChI=1/C3H9N/c1-4(2)3/h1-3H3/i1D3,2D3,3D3
(3) InChIKey: GETQZCLCWQTVFV-GQALSZNTEE

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