3-Nitrophenylarsonic acid

Base Information

• Chemical Name: 3-Nitrophenylarsonic acid
• CAS No.: 618-07-5
• Molecular Formula: C6H6AsNO5
• Molecular Weight: 247.039
• NSC Number: 4124
• UNII: 3A3VG264TW
• DSSTox Substance ID: DTXSID90210792
• Nikkaji Number: J35.591G
• Wikidata: Q27256949
• Mol file: 618-07-5.mol

Synonyms:3-Nitrophenylarsonic acid;m-Nitrophenylarsonic acid;(3-NITROPHENYL)ARSONIC ACID;Benzenearsonic acid, m-nitro-;m-Nitrobenzenearsonic acid;Arsonic acid, (3-nitrophenyl)-;618-07-5;NSC 4124;BRN 3032447;UNII-3A3VG264TW;AI3-14868;3A3VG264TW;NSC-4124;WLN: WNR C-AS-QQO;DTXSID90210792;NSC4124;Arsonic acid, (3-nitrophenyl)- (9CI);LS-29103;ARSONIC ACID, AS-(3-NITROPHENYL)-;Q27256949

Chemical Property of 3-Nitrophenylarsonic acid

Chemical Property:

• Vapor Pressure: 5.09E-12mmHg at 25°C
• Melting Point: >300 °C
• Boiling Point: 529°Cat760mmHg
• PKA: pK1:3.41;pK2:7.80 (25°C)
• Flash Point: 238.2°C
• PSA: 103.35000
• Density: g/cm³
• LogP: -0.32100
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 1
• Exact Mass: 246.946192
• Heavy Atom Count: 13
• Complexity: 244

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)(O)O)[N+](=O)[O-]

Technology Process of 3-Nitrophenylarsonic acid

There total 15 articles about 3-Nitrophenylarsonic acid 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: 39.0%

3-nitro-aniline (99-09-2) → 3-nitrophenylarsonic acid (618-07-5)

Guidance literature:

3-nitro-aniline; With hydrogenchloride; sodium tetrafluoroborate; sodium nitrite; In water; at 0 ℃; for 0.5h;

With sodium arsenite; copper(l) chloride; sodium hydroxide; In water; at 20 - 60 ℃;

With hydrogenchloride;

DOI:10.1021/acs.jmedchem.1c01441

Reference yield:

phenylarsonic acid (98-05-5) → 3-nitrophenylarsonic acid (618-07-5)

Guidance literature:

With nitric acid;

Reference yield:

→ 3-nitrophenylarsonic acid (618-07-5)

Guidance literature:

With trisodium arsenite; at 20 ℃;

upstream raw materials:

nitroaminophenylarsonic acid

phenylarsonic acid

(4-amino-3-nitro-phenyl)-arsonic acid

4-nitrobenzenediazonium chloride

Downstream raw materials:

(3-amino-phenyl)-arsonic acid

3-thioarsenoso-aniline

[Mn(m-NO₂C₆H₄AsO₄)(OH)(H₂O)]2

(3-ethoxycarbonylamino-phenyl)-arsonic acid