Trimethylpropylammonium bromide

• CAS: 2650-50-2
• Catalog Number: ACM2650502-1
• Category: Other Products
• Molecular Weight: 182.10
• Molecular Formula: C6H16BrN
• Synonyms: 1-Propanaminium, N,N,N-trimethyl-, bromide
• IUPAC Name: trimethyl(propyl)azanium bromide
• SMILES: CCC[N+](C)(C)C.[Br-]
• InChI: InChI=1S/C6H16N.BrH/c1-5-6-7(2,3)4;/h5-6H2,1-4H3;1H/q+1;/p-1
• InChI Key: FCGQIZKUTMUWDC-UHFFFAOYSA-M
• Complexity: 42.6
• Covalently-Bonded Unit Count: 2
• EC Number: 220-172-2
• Exact Mass: 181.04700
• H-Bond Acceptor: 1
• H-Bond Donor: 0
• Heavy Atom Count: 8
• Monoisotopic Mass: 181.047g/mol
• NSC Number: 97198
• Rotatable Bond Count: 2
• Topological Polar Surface Area: 0A^2

Synthetic Use

Upstream Synthesis Route 1

• 106-94-5
• 75-50-3

• 2650-50-2

Reference: [1] Justus Liebigs Annalen der Chemie, 1956, vol. 599, p. 13,20
[2] Journal of pharmaceutical sciences, 1966, vol. 55, # 4, p. 414 - 417
[3] Journal of the Chemical Society, Faraday Transactions 1: Physical Chemistry in Condensed Phases, 1989, vol. 85, # 9, p. 2669 - 2674
[4] Journal of Molecular Structure, 1997, vol. 435, # 3, p. 219 - 228
[5] Bulletin of the Chemical Society of Japan, 2011, vol. 84, # 3, p. 312 - 319

Upstream Synthesis Route 2

• 106-94-5
• 75-50-3

• 2650-50-2

Reference: [1]Justus Liebigs Annalen der Chemie,1956,vol. 599,p. 13,20
[2]Journal of Pharmaceutical Sciences,1966,vol. 55,p. 414 - 417
[3]Journal of the Chemical Society, Faraday Transactions 1: Physical Chemistry in Condensed Phases,1989,vol. 85,p. 2669 - 2674
[4]Journal of Molecular Structure,1997,vol. 435,p. 219 - 228
[5]Bulletin of the Chemical Society of Japan,2011,vol. 84,p. 312 - 319

Downstream Synthesis Route 1

• 2650-50-2

• 187737-37-7
• 926-63-6

Reference: [1]Journal of the American Chemical Society,1984,vol. 106,p. 7583 - 7588

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