Ethanol, 2,2'-[(3-nitrophenyl)imino]bis-

Base Information

• Chemical Name: Ethanol, 2,2'-[(3-nitrophenyl)imino]bis-
• CAS No.: 24812-82-6
• Molecular Formula: C10H14 N2 O4
• Molecular Weight: 226.232
• Hs Code.: 2922199090
• NSC Number: 103358
• DSSTox Substance ID: DTXSID3067025
• Nikkaji Number: J422.145A
• Wikidata: Q81993603
• ChEMBL ID: CHEMBL19408
• Mol file: 24812-82-6.mol

Synonyms:24812-82-6;Ethanol, 2,2'-[(3-nitrophenyl)imino]bis-;N,N-Bis(2-hydroxyethyl)-m-nitroaniline;2-[N-(2-hydroxyethyl)-3-nitroanilino]ethanol;Ethanol, 2,2'-((3-nitrophenyl)imino)bis-;NSC 103358;N,N-di-(2-Hydroxyethyl)-m-nitroaniline;Ethanol, 2,2'-((m-nitrophenyl)imino)di-;Ethanol, 2,2'-[(m-nitrophenyl)imino]di-;NSC103358;NCIOpen2_007139;Oprea1_351451;SCHEMBL23550;CHEMBL19408;2-[(2-hydroxyethyl)(3-nitrophenyl)amino]ethan-1-ol;DTXSID3067025;ADAL1233395;AKOS002384105;Ethanol,2'-[(m-nitrophenyl)imino]di-;NSC-103358;2,2'-[(3-Nitrophenyl)imino]bisethanol;Ethanol,2'-[(3-nitrophenyl)imino]bis-;2-[(2-hydroxyethyl)-3-nitroanilino]ethanol;N,N-BIS-(2-HYDROXYETHYL)-M-NITROANILINE;AE-641/01921001

Chemical Property of Ethanol, 2,2'-[(3-nitrophenyl)imino]bis-

Chemical Property:

• Vapor Pressure: 1.88E-08mmHg at 25°C
• Boiling Point: 438.2°C at 760 mmHg
• Flash Point: 218.8°C
• PSA: 89.52000
• Density: 1.352g/cm³
• LogP: 0.90900
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 5
• Rotatable Bond Count: 5
• Exact Mass: 226.09535693
• Heavy Atom Count: 16
• Complexity: 213

Purity/Quality:

99%min ^*data from raw suppliers

2,2'-(3-NITROPHENYLIMINO)-DIETHANOL 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

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

Technology Process of Ethanol, 2,2'-[(3-nitrophenyl)imino]bis-

There total 5 articles about Ethanol, 2,2'-[(3-nitrophenyl)imino]bis- 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: 88.5%

oxirane (75-21-8,99932-75-9) + 3-nitro-aniline (99-09-2) → 3-[N,N-Bis(2-hydroxyethyl)amino]nitrobenzene (24812-82-6)

Guidance literature:

With acetic acid; In water; at 20 ℃; for 72h; Cooling with ice;

Reference yield: 63.6%

oxirane (75-21-8,99932-75-9) + aniline (62-53-3) → 3-[N,N-Bis(2-hydroxyethyl)amino]nitrobenzene (24812-82-6)

Guidance literature:

In acetic acid;

Reference yield: 55.0%

3-nitro-aniline (99-09-2) + 2-chloro-ethanol (107-07-3) → 3-[N,N-Bis(2-hydroxyethyl)amino]nitrobenzene (24812-82-6)

Guidance literature:

With calcium carbonate; potassium iodide; In water; for 8h; Reflux;

DOI:10.1016/j.bmcl.2010.12.052

upstream raw materials:

oxirane

3-nitro-aniline

aniline

2-chloro-ethanol

Downstream raw materials:

N,N-bis(2-(methylsulfonyloxy)ethyl)-3-nitroaniline

N¹-(6,7-bis(2-methoxyethoxy)quinazolin-4-yl)-N³,N³-bis(2-chloroethyl)benzene-1,3-diamine hydrochloride

C₁₈H₁₆N₂O₆

2-Benzyloxycarbonylamino-3-{3-[bis-(2-chloro-ethyl)-amino]-phenylcarbamoyloxy}-propionic acid benzyl ester

Refernces

• 1、 -. "Model quinazoline chlorethazine compound and its preparation method and application for treating tumor (by machine translation)". Paragraph 0094; 0095; 0096. . Retrieved 2016/10/07.
• 2、 Lin, Song-Wen,Sun, Qi,Ge, Ze-Mei,Wang, Xin,Ye, Jia,Li, Run-Tao. "Synthesis and structure-analgesic activity relationships of a novel series of monospirocyclopiperazinium salts (MSPZ)". supporting information; experimental part. p. 940 - 943. Retrieved 2011/03/21.