2-(3-Nitrophenoxy)ethylamine

Base Information

• Chemical Name: 2-(3-Nitrophenoxy)ethylamine
• CAS No.: 26646-35-5
• Molecular Formula: C8H10N2O3
• Molecular Weight: 182.179
• Hs Code.: 2922299090
• DSSTox Substance ID: DTXSID20470706
• Nikkaji Number: J654.670F
• Wikidata: Q82298861
• Mol file: 26646-35-5.mol

Synonyms:2-(3-NITROPHENOXY)ETHYLAMINE;26646-35-5;2-(3-nitrophenoxy)ethanamine;MFCD12824702;Ethanamine, 2-(3-nitrophenoxy)-;SCHEMBL7873589;DTXSID20470706;2-(3-Nitrophenoxy)ethan-1-amine;AKOS010259593;SY008290;CS-0318231;FT-0753748

Chemical Property of 2-(3-Nitrophenoxy)ethylamine

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Boiling Point: 336.923°C at 760 mmHg
• PKA: 8.17±0.10(Predicted)
• Flash Point: 157.566°C
• PSA: 81.07000
• Density: 1.252g/cm³
• LogP: 2.15580
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 182.06914219
• Heavy Atom Count: 13
• Complexity: 169

Purity/Quality:

98%min ^*data from raw suppliers

2-(3-Nitrophenoxy)ethanamine 97% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of 2-(3-Nitrophenoxy)ethylamine

There total 3 articles about 2-(3-Nitrophenoxy)ethylamine 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:

meta-nitrophenol (554-84-7) → 2-(3-nitrophenoxy)ethanamine (26646-35-5)

Guidance literature:

Multi-step reaction with 2 steps

1: triphenylphosphine; diethylazodicarboxylate / tetrahydrofuran / 0 - 20 °C / Inert atmosphere

2: hydrazine hydrate / ethanol / 4 h / 50 °C

With hydrazine hydrate; triphenylphosphine; diethylazodicarboxylate; In tetrahydrofuran; ethanol;

DOI:10.1021/acsmedchemlett.6b00330

Reference yield:

1-(2-chloroethoxy)-3-nitrobenzene (87291-34-7) → 2-(3-nitrophenoxy)ethanamine (26646-35-5)

Guidance literature:

Multistep reaction; (i) phthalimide , (ii) N2H4*H2O;

Reference yield:

→ 2-(3-nitrophenoxy)ethanamine (26646-35-5)

Guidance literature:

entspr. Bromaethan, Gabriel-Rk.;

upstream raw materials:

1-(2-chloroethoxy)-3-nitrobenzene

meta-nitrophenol

Downstream raw materials:

C₁₂H₁₄N₂O₇

2-Isopropyl-5-[2-(3-nitro-phenoxy)-ethylamino]-2-(3,4,5-trimethoxy-phenyl)-pentanenitrile

5-[2-(3-Amino-phenoxy)-ethylamino]-2-isopropyl-2-(3,4,5-trimethoxy-phenyl)-pentanenitrile

meta-nitrophenol

Refernces