1-(4-Fluorophenyl)-2-(3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]decan-1-yl)ethanone;bromide

Base Information

Chemical Name:1-(4-Fluorophenyl)-2-(3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]decan-1-yl)ethanone;bromide
CAS No.:7468-87-3
Molecular Formula:Br*C₁₄H₁₈FN₄O
Molecular Weight:357.226
Hs Code.:
NSC Number:402765
DSSTox Substance ID:DTXSID60440180

Synonyms:7468-87-3;NSC 402765;AGN-PC-0N4O06;DTXSID60440180;NSC402765;AKOS016372291;NSC-402765;NS-00180;1-[2-(4-fluorophenyl)-2-oxoethyl]-1,3,5,7-tetraazatricyclo[3.3.1.1(3),?]decan-1-ium bromide

Suppliers and Price of 1-(4-Fluorophenyl)-2-(3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]decan-1-yl)ethanone;bromide

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
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price

Total 2 raw suppliers

Chemical Property of 1-(4-Fluorophenyl)-2-(3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]decan-1-yl)ethanone;bromide

Chemical Property:

Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:3
Exact Mass:356.06480
Heavy Atom Count:21
Complexity:367

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:C1N2CN3CN1C[N+](C2)(C3)CC(=O)C4=CC=C(C=C4)F.[Br-]

Technology Process of 1-(4-Fluorophenyl)-2-(3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]decan-1-yl)ethanone;bromide

There total 1 articles about 1-(4-Fluorophenyl)-2-(3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]decan-1-yl)ethanone;bromide 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:

: 100-97-0
hexamethylenetetramine

: 403-29-2
2-bromo-4'-fluoroacetophenone

: 7468-87-3
(4-fluoro-phenacyl)-hexamethylenetetraminium; bromide

Guidance literature:: With chloroform;
DOI:10.1021/ja01161a108

Reference yield: 85.36%

: 7468-87-3
(4-fluoro-phenacyl)-hexamethylenetetraminium; bromide

: 456-00-8
2-amino-4'-fluoroacetophenone hydrochloride

Guidance literature:: With hydrogenchloride; In methanol; water; at 20 ℃; Cooling with ice;

Reference yield:

: 7468-87-3
(4-fluoro-phenacyl)-hexamethylenetetraminium; bromide

: 113485-26-0
5-(4-fluorophenyl)-2-(4-pyridyl)oxazole

Guidance literature:: Multi-step reaction with 3 steps

1: 60 percent / 12 M HCl / methanol / 408 h / Ambient temperature

2: 18.7 g / pyridine / 92 h

3: POCl₃ / 16 h / Heating

With pyridine; hydrogenchloride; trichlorophosphate; In methanol;