Benzyltributylammonium chloride

• CAS: 23616-79-7
• Catalog Number: ACM23616797
• Category: Promotional Products
• Molecular Weight: 311.93
• Molecular Formula: C19H34ClN
• Synonyms: N-Benzyl-N,N-dibutylbutan-1-aminium chloride
• IUPAC Name: benzyl(tributyl)azanium;chloride
• Canonical SMILES: CCCC[N+](CCCC)(CCCC)CC1=CC=CC=C1.[Cl-]
• InChI: InChI=1S/C19H34N.ClH/c1-4-7-15-20(16-8-5-2,17-9-6-3)18-19-13-11-10-12-14-19;/h10-14H,4-9,15-18H2,1-3H3;1H/q+1;/p-1
• InChI Key: VJGNLOIQCWLBJR-UHFFFAOYSA-M
• Boiling Point: 466.93 °C
• Melting Point: 155-163 °C
• Solubility: Soluble in water
• Appearance: solid
• Storage: Sealed in dry, Room Temperature
• Complexity: 196
• Covalently-Bonded Unit Count: 2
• EC Number: 245-787-3
• Exact Mass: 311.2379778
• H-Bond Acceptor: 1
• Heavy Atom Count: 21
• Monoisotopic Mass: 311.2379778
• Physical State: White crystal or powder
• Refractive Index: 1.6
• Rotatable Bond Count: 11
• Topological Polar Surface Area: 0 Ų

Synthetic Use

Upstream Synthesis Route 1

• 102-82-9
• 100-44-7

• 23616-79-7

Reference: [1] Journal of the American Chemical Society, 1929, vol. 51, p. 3640
[2] Acta Chemica Scandinavica, Series B: Organic Chemistry and Biochemistry, 1974, vol. 28, p. 590
[3] International Journal of Chemical Kinetics, 1996, vol. 28, # 8, p. 615 - 626
[4] Petroleum Chemistry, 2002, vol. 42, # 1, p. 20 - 25
[5] New Journal of Chemistry, 2016, vol. 40, # 9, p. 7437 - 7444

Upstream Synthesis Route 2

• 25316-59-0

• 23616-79-7

Reference: [1] International Journal of Chemical Kinetics, 1996, vol. 28, # 8, p. 615 - 626
[2] New Journal of Chemistry, 2016, vol. 40, # 9, p. 7437 - 7444

Upstream Synthesis Route 3

• 25316-59-0

• 23616-79-7

Reference: [1]International Journal of Chemical Kinetics,1996,vol. 28,p. 615 - 626
[2]New Journal of Chemistry,2016,vol. 40,p. 7437 - 7444

Downstream Synthesis Route 1

• 1634-34-0
• 23616-79-7
• 572-09-8

• 209746-55-4

Reference: [1]Current Patent Assignee: MITSUBISHI CHEMICAL HOLDINGS CORPORATION - US6048842, 2000, A

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