N-(tert-Butyl)hydroxylamine hydrochloride

Base Information

• Chemical Name: N-(tert-Butyl)hydroxylamine hydrochloride
• CAS No.: 57497-39-9
• Molecular Formula: C4H12ClNO
• Molecular Weight: 125.598
• Hs Code.: 29280090
• European Community (EC) Number: 260-771-6
• DSSTox Substance ID: DTXSID60206107
• Mol file: 57497-39-9.mol

Synonyms:N-tert-butylhydroxylamine;N-tert-butylhydroxylamine hydrochloride

Chemical Property of N-(tert-Butyl)hydroxylamine hydrochloride

Chemical Property:

• Appearance/Colour: White to off-white powder
• Melting Point: 183-185 °C(lit.)
• Boiling Point: 120.9 °C at 760 mmHg
• Flash Point: 43.6 °C
• PSA: 32.26000
• Density: 0.883g/cm3
• LogP: 1.95660
• Storage Temp.: Inert atmosphere,Room Temperature
• Sensitive.: Hygroscopic
• Water Solubility.: Soluble in water
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 125.0607417
• Heavy Atom Count: 7
• Complexity: 37.3

Purity/Quality:

98%,99%, ^*data from raw suppliers

N-(tert-Butyl)hydroxylamine Hydrochloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 22-24/25-36-26

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: CC(C)(C)NO.Cl
• Uses: N-tert-Butylhydroxylamine hydrochloride was used in spin trapping of short-lived radicals. It was also used in the synthesis of α-ketoamides and 3-spirocyclopropanated 2-azetidinones.

Technology Process of N-(tert-Butyl)hydroxylamine hydrochloride

There total 1 articles about N-(tert-Butyl)hydroxylamine hydrochloride 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:

N-t-butylethylamine (4432-77-3) → N-tertbutylhydroxylamine hydrochloride (57497-39-9)

Guidance literature:

N-t-butylethylamine; With dihydrogen peroxide; In methanol; water; at 40 - 60 ℃; for 6.5h;

With hydrogenchloride; In water; for 4h; under 37.5038 - 112.511 Torr; Reflux;

Reference yield: 100.0%

N-tertbutylhydroxylamine hydrochloride (57497-39-9) + benzaldehyde (100-52-7) → (Z)-N-benzylidene-2-methylpropan-2-amine oxide (3376-24-7,52392-70-8,85225-53-2,68315-30-0)

Guidance literature:

With sodium hydrogencarbonate; at 20 ℃; for 2h;

DOI:10.1016/j.tet.2008.03.091

Reference yield: 100.0%

ethyl 2-[(2-nitrophenyl)methyl]buta-2,3-dienoate + N-tertbutylhydroxylamine hydrochloride (57497-39-9) → 2-tert-butyl-3-methyl-[(2-nitrophenyl)methyl]isoxazol-5-one

Guidance literature:

With triethylamine; In toluene; at 100 ℃; for 0.166667h;

upstream raw materials:

N-t-butylethylamine

Downstream raw materials:

2-tert-butyl-3-methylamino-4-phenyl-2H-isoxazol-5-one

N-tert.-Butyl-N,O-bis-(phenylcarbamoyl)-hydroxylamin

dibenzyl P-(N-tert-butyl-hydroxyaminomethyl)phosphonate

1-tert-Butyl-1-hydroxy-2-phenylisourea hydrochloride

Refernces