3-Bromo-1-tosylazepan-4-one

Base Information

Chemical Name:3-Bromo-1-tosylazepan-4-one
CAS No.:171009-43-1
Molecular Formula:C13H16BrNO3S
Molecular Weight:346.24000
Hs Code.:2933990090
DSSTox Substance ID:DTXSID60434706
Mol file:171009-43-1.mol

Synonyms:3-Bromo-1-tosylazepan-4-one;171009-43-1;1-tosyl-3-bromo-azepan-4-one;3-bromo-1-(4-methylphenyl)sulfonylazepan-4-one;SCHEMBL3305712;DTXSID60434706;LRYHVCXCQGYIMI-UHFFFAOYSA-N;3-bromo-1-[(4-methylphenyl)sulfonyl]-4-azepanone;3-BROMO-1-(4-METHYLBENZENESULFONYL)AZEPAN-4-ONE

Suppliers and Price of 3-Bromo-1-tosylazepan-4-one

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
Packaging
price

Crysdot
3-Bromo-1-tosylazepan-4-one 95+%
1g
$ 668.00

Chemenu
3-bromo-1-tosylazepan-4-one 95%
1g
$ 631.00

American Custom Chemicals Corporation
3-BROMO-1-TOSYLAZEPAN-4-ONE 95.00%
5MG
$ 503.20

Alichem
3-Bromo-1-tosylazepan-4-one
1g
$ 560.32

Total 4 raw suppliers

Chemical Property of 3-Bromo-1-tosylazepan-4-one

Chemical Property:

PSA：62.83000
LogP:3.13080
Storage Temp.:Inert atmosphere,Store in freezer, under -20°C
XLogP3:2.1
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:345.00343
Heavy Atom Count:19
Complexity:424

Purity/Quality:

85.0-99.8% ^*data from raw suppliers

3-Bromo-1-tosylazepan-4-one 95+% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=CC=C(C=C1)S(=O)(=O)N2CCCC(=O)C(C2)Br

Technology Process of 3-Bromo-1-tosylazepan-4-one

There total 2 articles about 3-Bromo-1-tosylazepan-4-one 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: 90.0%

: 171009-42-0
3-bromo-5-ethoxycarbonyl-1-(4'-methylphenylsulfonyl)azepan-4-one

: 171009-43-1
3-bromo-1-(4'-methylphenylsulfonyl)azepan-4-one

Guidance literature:: With hydrogenchloride; In 1,4-dioxane; water; for 7h; Heating;

Reference yield:

: 33439-27-9
N-tosyl-4-piperidone

: 171009-43-1
3-bromo-1-(4'-methylphenylsulfonyl)azepan-4-one

Guidance literature:: Multi-step reaction with 3 steps

1: 98 percent / Br₂ / CH₂Cl₂ / -4 deg C, 90 min; 0 deg C, 30 min; room temperature, 1 h

2: 71 percent / BF₃-Et₂O / CH₂Cl₂ / -5 deg C -> room temperature, 90 min

3: 90 percent / HCl / H₂O; dioxane / 7 h / Heating

With hydrogenchloride; boron trifluoride diethyl etherate; bromine; In 1,4-dioxane; dichloromethane; water;