ARSINE, (m-NITROPHENYL)OXO-

Base Information

• Chemical Name: ARSINE, (m-NITROPHENYL)OXO-
• CAS No.: 6333-94-4
• Molecular Formula: C6H4AsNO3
• Molecular Weight: 213.024
• NSC Number: 31744
• UNII: WZ728DMX2A
• DSSTox Substance ID: DTXSID70212714
• Wikidata: Q83087892
• Mol file: 6333-94-4.mol

Synonyms:1-arsoroso-3-nitrobenzene;ARSINE, (m-NITROPHENYL)OXO-;(m-Nitrophenyl)oxoarsine;NSC 31744;6333-94-4;BRN 3242863;WZ728DMX2A;NSC-31744;NSC31744;UNII-WZ728DMX2A;ANTINEOPLASTIC-31744;DTXSID70212714;LS-21855

Chemical Property of ARSINE, (m-NITROPHENYL)OXO-

Chemical Property:

• Boiling Point: °Cat760mmHg
• Flash Point: °C
• Density: g/cm³
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 0
• Exact Mass: 212.940713
• Heavy Atom Count: 11
• Complexity: 168

Purity/Quality:

99% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=CC(=C1)[As]=O)[N+](=O)[O-]

Technology Process of ARSINE, (m-NITROPHENYL)OXO-

There total 2 articles about ARSINE, (m-NITROPHENYL)OXO- 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: 63.0%

3-nitrophenylarsonic acid (618-07-5) → m-nitrophenylarsenic oxide (6333-94-4)

Guidance literature:

With iodine; ascorbic acid; In methanol; at 20 ℃; for 4h;

DOI:10.1080/10426500500272335

Reference yield:

3-nitro-aniline (99-09-2) → m-nitrophenylarsenic oxide (6333-94-4)

Guidance literature:

Multi-step reaction with 2 steps

1.1: sodium nitrite; sodium tetrafluoroborate; hydrogenchloride / water / 0.5 h / 0 °C

1.2: 20 - 60 °C

1.3: activated charcoal

2.1: hydrogenchloride; sulfur dioxide; potassium iodide / methanol / 0.5 h / 20 °C

2.2: 20 °C

With hydrogenchloride; sodium tetrafluoroborate; sulfur dioxide; potassium iodide; sodium nitrite; In methanol; water;

DOI:10.1021/acs.jmedchem.1c01441

Reference yield:

m-nitrophenylarsenic oxide (6333-94-4) + ethane-1,2-dithiol (540-63-6) → C8H8AsNO2S2

Guidance literature:

In ethanol; for 0.5h; Reflux;

upstream raw materials:

3-nitrophenylarsonic acid

3-nitro-aniline

Downstream raw materials:

dibromo-(3-nitro-phenyl)-arsine

diiodo-(3-nitro-phenyl)-arsine

Refernces

• 1、 -. "Organoarsenic compound and use thereof". Paragraph 0078; 0083; 0087. . Retrieved 2019/03/06.