Ethylene-d4-diamine

Base Information

• Chemical Name: Ethylene-d4-diamine
• CAS No.: 37164-19-5
• Molecular Formula: C2H4 D4 N2
• Molecular Weight: 64.12
• European Community (EC) Number: 687-205-4
• DSSTox Substance ID: DTXSID00480181
• Nikkaji Number: J1.358.351J
• Mol file: 37164-19-5.mol

Synonyms:Ethylene-d4-diamine;37164-19-5;Ethylene-d4 Diamine;1,1,2,2-tetradeuterioethane-1,2-diamine;ETHYLENEDIAMINE-D4;Ethylene-d?-diamine;1,2-Ethane-1,1,2,2-d4-diamine;DTXSID00480181;AKOS015894663;HY-W127840;CS-0186009;D99548;Ethylene-d4-diamine, 98 atom % D, 98% (CP)

Chemical Property of Ethylene-d4-diamine

Chemical Property:

• Vapor Pressure: 15.8mmHg at 25°C
• Melting Point: 9 °C(lit.)
• Refractive Index: n20/D 1.455(lit.)
• Boiling Point: 118 °C(lit.)
• Flash Point: 93 °F
• PSA: 52.04000
• Density: 1.022 g/mL at 25 °C
• LogP: 0.30440
• XLogP3: -2
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 64.093855247
• Heavy Atom Count: 4
• Complexity: 6

Purity/Quality:

99% ^*data from raw suppliers

Ethylene-d4 Diamine ^*data from reagent suppliers

Safty Information:

• Hazard Codes: C
• Statements: 10-21/22-34-42/43
• Safety Statements: 23-26-36/37/39-45

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(CN)N
• Isomeric SMILES: [2H]C([2H])(C([2H])([2H])N)N
• Uses: Isotope labelled Ethylene Diamine(Ethylene-d4 Diamine), a chemical reagent used in the production of various derivatives containing varying functional groups. It is also a known chelating agent. It has also been seen to reduce seizures caused by systematic injection of proconvulsants. It displays antiepileptic and anxiolytic activity.

Technology Process of Ethylene-d4-diamine

There total 2 articles about Ethylene-d4-diamine which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 66.0%

2,2'-(ethane-1,1,2,2-d4-1,2-diyl)diisoindoline-1,3-dione → ethylene-d4-diamine (37164-19-5)

Guidance literature:

With hydrazine hydrate; In methanol; Reflux;

DOI:10.1002/jlcr.2977

Reference yield:

→ ethylene-d4-diamine (37164-19-5)

Guidance literature:

Dibrom-tetradeuterio-ethan, Ammoniak, +55grad;

DOI:10.1016/0022-1902(64)80335-3

Reference yield: 90.0%

ethylene-d4-diamine (37164-19-5) + 2-methyl-benzyl alcohol (89-95-2) → N,N'-bis(salicilidine)-1,2-d4-ethylenediamine

Guidance literature:

In ethanol; for 24h; Heating;

DOI:10.1021/ja045491s

Downstream raw materials:

C₁₆H₁₀⁽²⁾H₄Cl₂N₂

(+/-)-[4,4,5,5-(2)H4]-2-(1-[2,6-dichlorophenoxy]ethyl)-Δ2-imidazoline

⁽²⁾H₄-oxymethazoline

Refernces

• 1、 Yang, Jun,Hong, Kunlun,Bonnesen, Peter V.. "Synthesis of N1-tritylethane-1,1,2,2-d4-1,2-diamine: A novel mono-protected C-deuterated ethylenediamine synthon". . p. 463 - 466. Retrieved 2013/02/22.