Benzyltriethylammonium chloride

• CAS: 56-37-1
• Catalog Number: ACM56371-4
• Category: Ammonium Ionic Liquids
• Molecular Weight: 227.77
• Molecular Formula: C13H22ClN
• Synonyms: BTEAC
• IUPAC Name: benzyl(triethyl)azanium;chloride
• Canonical SMILES: CC[N+](CC)(CC)CC1=CC=CC=C1.[Cl-]
• InChI: InChI=1S/C13H22N.ClH/c1-4-14(5-2,6-3)12-13-10-8-7-9-11-13;/h7-11H,4-6,12H2,1-3H3;1H/q+1;/p-1
• InChI Key: HTZCNXWZYVXIMZ-UHFFFAOYSA-M
• Application: Metal Plating, Electropolishing, Metal Reprocessing, Phase transfer media, Batteries Fuel Cells, Nanomaterials, Industrial Solvents, Nuclear Fuel Red Waste, Enzymatic Catalysis, Lubricants Heat Transfer and Solar Energy Conversion.
• Storage: Store below +30°C.
• Chemical Formula: N2,2,2,BzCl
• Complexity: 135
• Covalently-Bonded Unit Count: 2
• EC Number: 200-270-1
• Exact Mass: 227.144g/mol
• H-Bond Acceptor: 1
• Heavy Atom Count: 15
• Monoisotopic Mass: 227.144g/mol
• NSC Number: 152923
• Physical Description: Liquid
• Physical State: White crystal or powder
• Rotatable Bond Count: 5
• Topological Polar Surface Area: 0A^2
• UNII: 46WDQ3ADML

Custom Q&A

What is the molecular formula of Benzyltriethylammonium Chloride?

The molecular formula of Benzyltriethylammonium Chloride is C13H22ClN.

What is the molecular weight of Benzyltriethylammonium Chloride?

The molecular weight of Benzyltriethylammonium Chloride is 227.77 g/mol.

What is the IUPAC name of Benzyltriethylammonium Chloride?

The IUPAC name of Benzyltriethylammonium Chloride is benzyl(triethyl)azanium;chloride.

What is the InChI of Benzyltriethylammonium Chloride?

The InChI of Benzyltriethylammonium Chloride is InChI=1S/C13H22N.ClH/c1-4-14(5-2,6-3)12-13-10-8-7-9-11-13;/h7-11H,4-6,12H2,1-3H3;1H/q+1;/p-1.

What is the canonical SMILES of Benzyltriethylammonium Chloride?

The canonical SMILES of Benzyltriethylammonium Chloride is CC[N+](CC)(CC)CC1=CC=CC=C1.[Cl-].

What is the CAS number of Benzyltriethylammonium Chloride?

The CAS number of Benzyltriethylammonium Chloride is 56-37-1.

What is the hydrogen bond donor count of Benzyltriethylammonium Chloride?

The hydrogen bond donor count of Benzyltriethylammonium Chloride is 0.

What is the hydrogen bond acceptor count of Benzyltriethylammonium Chloride?

The hydrogen bond acceptor count of Benzyltriethylammonium Chloride is 1.

How many rotatable bonds does Benzyltriethylammonium Chloride have?

Benzyltriethylammonium Chloride has 5 rotatable bonds.

What is the topological polar surface area of Benzyltriethylammonium Chloride?

The topological polar surface area of Benzyltriethylammonium Chloride is 0.2.

Synthetic Use

Upstream Synthesis Route 1

• 100-44-7
• 121-44-8

• 56-37-1

Reference: [1] Organic Syntheses, 1981, vol. 60, p. 66 - 71

Upstream Synthesis Route 2

• 100-44-7

• 56-37-1

Reference: [1] Patent: US4649220, 1987, A,

Upstream Synthesis Route 3

• 100-44-7
• 121-44-8

• 56-37-1

Reference: [1]Organic Syntheses,1981,vol. 60,p. 66 - 71

Downstream Synthesis Route 1

• 89282-12-2
• 56-37-1

• 165547-79-5

Reference: [1] Patent: US6117888, 2000, A,

Downstream Synthesis Route 2

• 3240-72-0
• 56-37-1

• 2879-14-3

Reference: [1]Chemistry of Heterocyclic Compounds,1991,vol. 27,p. 1030
Khimiya Geterotsiklicheskikh Soedinenii,1991,p. 1275

Downstream Synthesis Route 3

• 201230-82-2
• 56-37-1

• 103-82-2

Reference: [1]Journal of Organic Chemistry,1983,vol. 48,p. 1919 - 1921

* For details of the synthesis route, please refer to the original source to ensure accuracy.