N-(tert-Butyl)hydroxylamine acetate

Base Information

• Chemical Name: N-(tert-Butyl)hydroxylamine acetate
• CAS No.: 253605-31-1
• Molecular Formula: C4H11NO.C2H4O2
• Molecular Weight: 149.19
• Hs Code.: 2928000090
• European Community (EC) Number: 607-710-5
• UNII: 2VMZ1ZD667
• DSSTox Substance ID: DTXSID50180008
• Wikidata: Q27255658
• Mol file: 253605-31-1.mol

Synonyms:N-(tert-Butyl)hydroxylamine acetate;253605-31-1;TBHA;tert-Butylhydroxylamine acetate;N-Tert-butylhydroxylamine acetate;t-Butylhydroxylamine acetate;acetic acid;N-tert-butylhydroxylamine;UNII-2VMZ1ZD667;2VMZ1ZD667;2-Propanamine, N-hydroxy-2-methyl-, acetate (1:1);2-Propanamine, N-hydroxy-2-methyl-, acetate (salt);N-(TERT-BUTYL)HYDROXYL AMINE ACETATE(TBHA);SCHEMBL283399;DTXSID50180008;N-(tert-Butyl)hydroxylamineacetate;MFCD01321354;AKOS016000593;CS-W022903;AS-11467;N-(tert-Butyl)hydroxylamine acetate 97;N-(tert-Butyl)hydroxylamine acetate, 97%;T-BUTYLHYDROXYLAMINE ACETATE [INCI];A877610;J-015954;Q27255658

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

Chemical Property:

• Vapor Pressure: 7.19mmHg at 25°C
• Melting Point: 65-69 °C(lit.)
• Boiling Point: 120.9°C at 760 mmHg
• Flash Point: 43.6°C
• PSA: 69.56000
• LogP: 1.24550
• Storage Temp.: under inert gas (nitrogen or Argon) at 2-8°C
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 1
• Exact Mass: 149.10519334
• Heavy Atom Count: 10
• Complexity: 68.3

Purity/Quality:

97% ^*data from raw suppliers

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

Safty Information:

• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)O.CC(C)(C)NO
• Uses: N-(tert-Butyl)hydroxylamine acetate has been used in a study to understand its effect on CD (cathepsin D) activity.It may be used in the preparation of: (Z)-α-5-bromo-N-tert-butyl-2-methoxyphenylnitroneONO-type pincer ligandhydroxyphenyl nitrones

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

There total 1 articles about N-(tert-Butyl)hydroxylamine acetate 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%

→ N-tertiary butyl hydroxyl amine acetate (253605-31-1)

Guidance literature:

Reference yield: 92.0%

3-formyl-N-((pyridin-2-yl)methyl)benzamide + N-tertiary butyl hydroxyl amine acetate (253605-31-1) → 2-methyl-N-(3-((pyridin-2-ylmethyl)carbamoyl)benzylidine)propan-2-amineoxide

Guidance literature:

With triethylamine; In dichloromethane; at 0 - 20 ℃;

DOI:10.1002/adsc.201200876

Reference yield: 59.0%

2,4,6-trimethoxybenzaldehyde (830-79-5) + N-tertiary butyl hydroxyl amine acetate (253605-31-1) → N-tert-butyl-α-(2,4,6-trimethoxy)phenylnitrone (57833-64-4)

Guidance literature:

With pyrrolidine; In dichloromethane; at 20 ℃; for 1h; Inert atmosphere;

DOI:10.1039/c9nj03805a

Downstream raw materials:

C₁₂H₁₇NO₂

C₁₂H₁₆BrNO

C₁₆H₂₆N₂O₂

N-(3-(1-hydroxy-3-phenylpropan-2-yl carbamoyl)benzylidene)-2-methylpropan-2-amineoxide