Triethyl-d15-amine

Base Information

• Chemical Name: Triethyl-d15-amine
• CAS No.: 66688-79-7
• Molecular Formula: (CD3CD2)3N
• Molecular Weight: 116.28
• European Community (EC) Number: 633-168-4
• DSSTox Substance ID: DTXSID50583737
• Nikkaji Number: J3.167.774B
• Wikidata: Q82475341
• Mol file: 66688-79-7.mol

Synonyms:Triethyl-d15-amine;66688-79-7;TRIETHYLAMINE-D15;1,1,2,2,2-pentadeuterio-N,N-bis(1,1,2,2,2-pentadeuterioethyl)ethanamine;SCHEMBL1332728;DTXSID50583737;D98114;N,N-Bis[(~2~H_5_)ethyl](~2~H_5_)ethanamine;Triethyl-d15-amine, 98 atom % D, 98% (CP)

Chemical Property of Triethyl-d15-amine

Chemical Property:

• Melting Point: -115oC(lit.)
• Refractive Index: n20/D 1.396(lit.)
• Boiling Point: 88.8oC(lit.)
• Flash Point: 20 °F
• PSA: 3.24000
• Density: 0.835 g/mL
• LogP: 1.34810
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 3
• Exact Mass: 116.214600672
• Heavy Atom Count: 7
• Complexity: 25.7

Purity/Quality:

98%min ^*data from raw suppliers

Triethylamine-d15 ^*data from reagent suppliers

Safty Information:

• Pictogram(s): F,C
• Hazard Codes: F,C
• Statements: 11-20/21/22-35
• Safety Statements: 3-16-26-29-36/37/39-45

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCN(CC)CC
• Isomeric SMILES: [2H]C([2H])([2H])C([2H])([2H])N(C([2H])([2H])C([2H])([2H])[2H])C([2H])([2H])C([2H])([2H])[2H]

Technology Process of Triethyl-d15-amine

There total 1 articles about Triethyl-d15-amine 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:

triethylamine (121-44-8) → [D15]triethylamine (66688-79-7)

Guidance literature:

With benzene-d6; C₂₄H₅₁IrP₂; In Cyclooctan; at 150 ℃; for 24h; Inert atmosphere; Glovebox;

DOI:10.1021/acs.organomet.6b00324

Reference yield: 51.0%

diazoacetic acid ethyl ester (623-73-4) + 4-tert-Butylstyrene (1746-23-2,26009-55-2) + [D15]triethylamine (66688-79-7) → D14-ethyl 4-(4-(tert-butyl)phenyl)-2-(1-(diethylamino)ethyl)-4-oxobutanoate

Guidance literature:

With tert.-butylhydroperoxide; cobalt acetylacetonate; In 1,4-dioxane; dichloromethane; water; at 60 ℃; for 8h; Molecular sieve;

DOI:10.1002/anie.201408874

Reference yield: 20.0%

benzaldehyde (100-52-7) + [D15]triethylamine (66688-79-7) → C9H6(2)H2O

Guidance literature:

With chloro-trimethyl-silane; ytterbium(III) triflate; In dichloromethane; at 20 ℃; for 114h; Mechanism; Inert atmosphere;

DOI:10.1016/j.tetlet.2009.11.014

upstream raw materials:

triethylamine