N-tert-Butylhydroxylamine

Base Information

• Chemical Name: N-tert-Butylhydroxylamine
• CAS No.: 16649-50-6
• Molecular Formula: C4H11NO
• Molecular Weight: 89.1374
• Hs Code.: 2928000090
• European Community (EC) Number: 877-853-8
• NSC Number: 150349,239719
• UNII: BQ5JE2DA91
• DSSTox Substance ID: DTXSID80168112
• Nikkaji Number: J26.144K
• Wikidata: Q72503325
• ChEMBL ID: CHEMBL555486
• Mol file: 16649-50-6.mol

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

Chemical Property of N-tert-Butylhydroxylamine

Chemical Property:

• Vapor Pressure: 7.19mmHg at 25°C
• Melting Point: 64℃
• Boiling Point: 120.922 °C at 760 mmHg
• PKA: 14.20±0.50(Predicted)
• Flash Point: 43.614 °C
• PSA: 32.26000
• Density: 0.883 g/cm³
• LogP: 1.15460
• XLogP3: 0.3
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 89.084063974
• Heavy Atom Count: 6
• Complexity: 37.3

Purity/Quality:

99% ^*data from raw suppliers

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

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(C)(C)NO

Technology Process of N-tert-Butylhydroxylamine

There total 21 articles about N-tert-Butylhydroxylamine 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: 100.0%

2-Methyl-2-nitropropane (594-70-7) → N-tert-Butylhydroxylamine (16649-50-6)

Guidance literature:

With acetic acid; zinc; In ethanol; at 10 - 20 ℃; for 3h;

Reference yield: 95.0%

(Z)-1-(1,1-dimethylathyl)-2-phthalimido-diazen-1-oxid (78661-66-2,78661-76-4,131229-52-2) → N-tert-Butylhydroxylamine (16649-50-6)

Guidance literature:

With hydrazine hydrate; at 5 ℃;

DOI:10.1002/hlca.19810640325

Reference yield: 85.0%

tert-butylamine (75-64-9) → N-tert-Butylhydroxylamine (16649-50-6)

Guidance literature:

With urea hydrogen peroxide adduct; In diethyl ether; at 20 ℃; for 1h; Catalytic behavior; Inert atmosphere;

DOI:10.1039/d0nj00829j

upstream raw materials:

diethyl ether

ethyl nitrite

tert-butylmagnesium chloride

2-tert-butyl-3-methoxy-oxaziridine

Downstream raw materials:

N-tert-butyl-α-(4-nitrophenyl)nitrone

N-tert-butyl-α-phenylnitrone

N-(Styryliden)-tert-butylamin-N-oxid

3-tert.-Butyl-1,2-dicyclohexyl-3-hydroxyguanidin

Refernces

• 1、 Iversen,P.E.,Lund,H.. "-". . p. 4027 - 4030. Retrieved 1967.
• 2、 Egger, Notker,Hoesch, Lienhard,Dreiding, Andre S.. "Das Hydrierprodukt eines β-Nitro-N-nitrosoamins ist kein 1,2,3-Triazolidin, sondern ein β-Hydroxylamino-N-nitrosoamin". . p. 2558 - 2562. Retrieved 1982.
• 3、 Sayo et al.. "-". . p. 1717. Retrieved 1968.
• 4、 -. "TREATMENT OF DRUG RESISTANT GLIOMAS". Page/Page column 21-22. . Retrieved 2019/04/16.
• 5、 Yin,Andersen,Thomsen,Skibsted,Hedegaard. "Formation of radicals during heating lysine and glucose in solution with an intermediate water activity". . p. 643 - 650. Retrieved 2013/08/23.