O-phenylhydroxylamine

Base Information

• Chemical Name: O-phenylhydroxylamine
• CAS No.: 4846-21-3
• Molecular Formula: C6H7NO
• Molecular Weight: 109.128
• European Community (EC) Number: 842-728-9
• DSSTox Substance ID: DTXSID70870434
• Nikkaji Number: J181.292K
• Metabolomics Workbench ID: 122766
• ChEMBL ID: CHEMBL1213940
• Mol file: 4846-21-3.mol

Synonyms:O-phenylhydroxylamine;4846-21-3;phenoxyamine;Hydroxylamine, O-phenyl-;O-(phenyl)hydroxylamine;N-phenoxyamine;Phenyl-O-Hydroxylamine;SCHEMBL81184;CHEMBL1213940;DTXSID70870434;UOKZUTXLHRTLFH-UHFFFAOYSA-N;AKOS006228082;EN300-111924;A800458

Chemical Property of O-phenylhydroxylamine

Chemical Property:

• Boiling Point: 72-72.5 °C(Press: 7 Torr)
• PKA: 1.73±0.70(Predicted)
• Density: 1.084±0.06 g/cm3(Predicted)
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 109.052763847
• Heavy Atom Count: 8
• Complexity: 59.5

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)ON

Technology Process of O-phenylhydroxylamine

There total 14 articles about O-phenylhydroxylamine 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: 89.0%

(Z)-ethyl N-phenoxyacetimidate → O-phenylhydroxylamine (4846-21-3)

Guidance literature:

With hydrogenchloride; In 1,4-dioxane; water; at 0 - 20 ℃; for 1.08333h; Inert atmosphere;

DOI:10.1002/chem.201403519

Reference yield: 87.0%

2-phenoxyisoindol-1,3-dione (64908-64-1) → O-phenylhydroxylamine (4846-21-3)

Guidance literature:

With hydrazine hydrate; In chloroform;

DOI:10.1002/anie.201507641

Reference yield: 54.0%

phenol (108-95-2,27073-41-2) → O-phenylhydroxylamine (4846-21-3)

Guidance literature:

With N-hydroxy-2,4,6-trimethylbenzensulfonamide; potassium tert-butylate; 1.) methanol, 2.) dimethylformamide, 0 deg C, 0.5 h;

DOI:10.1055/s-1980-29053

upstream raw materials:

phenol

p-nitrophenoxyamine

2-phenoxyisoindol-1,3-dione

phenylboronic acid

Downstream raw materials:

O-phenyl-N-acetoacetylhydroxylamine

C₁₀H₁₄N₂O₂

Formaldehyde O-phenyl-oxime

O-phenyl-N-((trifluoromethyl)sulfonyl)hydroxylamine