N,N'-Bis(2-hydroxyethyl)-2-nitro-p-phenylenediamine

Base Information

• Chemical Name: N,N'-Bis(2-hydroxyethyl)-2-nitro-p-phenylenediamine
• CAS No.: 84041-77-0
• Molecular Formula: C10H15N3O4
• Molecular Weight: 241.247
• Hs Code.: 2922199090
• European Community (EC) Number: 281-856-4
• UNII: 3X0E669O5S
• DSSTox Substance ID: DTXSID90232939
• Nikkaji Number: J297.460F
• Wikidata: Q27258153
• Mol file: 84041-77-0.mol

Synonyms:84041-77-0;2,2'-((2-Nitro-1,4-phenylene)bis(azanediyl))diethanol;N,N'-Bis(2-hydroxyethyl)-2-nitro-p-phenylenediamine;BIS-1,4-(2-HYDROXYETHYLAMINO)-2-NITROBENZENE;2-[4-(2-hydroxyethylamino)-3-nitroanilino]ethanol;EINECS 281-856-4;N,N'-Bis(2-hydroxyethyl)-2-nitro-4-phenylenediamine;UNII-3X0E669O5S;3X0E669O5S;2,2'-[(2-Nitro-1,4-phenylene)diimino]bis[ethanol];Ethanol, 2,2'-((2-nitro-1,4-phenylene)diimino)bis-;HC Violet BS;jarocol violet 14d;2,2'-((2-Nitro-1,4-phenylene)diimino)bisethanol;2,2'-[(2-nitro-1,4-phenylene)diimino]bisethanol;Ethanol, 2,2'-[(2-nitro-1,4-phenylene)diimino]bis-;COLOREX VBS;VELSOL VIOLET BS;SCHEMBL127370;DTXSID90232939;HWQZRURILVPDGN-UHFFFAOYSA-N;COVARIANE POURPRE W 5121;MFCD00239474;AKOS015890004;AC-8297;AS-12432;CS-0137544;FT-0626867;Bis-1,4-(2-Hydroxyethylamino)-2-Nitro Benzene;n,n'-bis(hydroxyethyl)-2-nitro-p-phenylenediamine;2,2'-[(2-Nitro-1,4-phenylene)bisimino]bisethanol;n,n-bis(2-hydroxyethyl)-2-nitro-p-phenylenediamine;W-104125;2,2'-(2-nitro-1,4-phenylene)bis(azanediyl)diethanol;Q27258153;2, 2'- [(2- nitro- 1, 4- phenylene)diimino]bisethanol;2,2\'-((2-Nitro-1,4-phenylene)bis(azanediyl))diethanol;N1,N4-BIS(2-HYDROXYETHYL)-2-NITRO-P-PHENYLENEDIAMINE;2,2'-((2-Nitro-1,4-phenylene)bis(azanediyl))bis(ethan-1-ol);N,N'-BIS(2-HYDROXYETHYL)-2-NITRO-P-PHENYLENEDIAMINE [INCI];1-(beta-hydroxyethyl)amino-2-nitro-4-[(beta-hydroxyethyl)amino]benzene

Chemical Property of N,N'-Bis(2-hydroxyethyl)-2-nitro-p-phenylenediamine

Chemical Property:

• Appearance/Colour: Dark brown to violet powder
• Vapor Pressure: 4.44E-06mmHg at 25°C
• Melting Point: 102-103 °C
• Refractive Index: 1.625
• Boiling Point: 512.7 °C at 760 mmHg
• PKA: 14.61±0.10(Predicted)
• Flash Point: 263.9 °C
• PSA: 110.34000
• Density: 1.434 g/cm³
• LogP: 1.07240
• Storage Temp.: 2-8°C(protect from light)
• XLogP3: 1
• Hydrogen Bond Donor Count: 4
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 6
• Exact Mass: 241.10625597
• Heavy Atom Count: 17
• Complexity: 234

Purity/Quality:

99% ^*data from raw suppliers

Bis-1,4-(2-hydroxyethylamino)-2-nitrobenzene ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC(=C(C=C1NCCO)[N+](=O)[O-])NCCO

Technology Process of N,N'-Bis(2-hydroxyethyl)-2-nitro-p-phenylenediamine

There total 1 articles about N,N'-Bis(2-hydroxyethyl)-2-nitro-p-phenylenediamine 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:

N-[4-(β-hydroxyethyl)amino-3-nitrophenyl]oxazolidone (104679-41-6) → 2,5-bis(2-hydroxyethyl)-amino-nitrobenzene (84041-77-0)

Guidance literature:

With sodium hydroxide; In ethanol;

Reference yield: 10.0%

2,5-bis(2-hydroxyethyl)-amino-nitrobenzene (84041-77-0) → 2-nitro-1-amino-4-[bis-(2-hydroxyethyl)-amino]-benzene (29705-39-3) + 2-hydroxy-5-N-(2'-hydroxyethyl)amino-1-nitrobenzene (165672-32-2)

Guidance literature:

With ammonium hydroxide; sodium sulfite; In methanol; at 70 ℃; for 24h;

DOI:10.1016/S0040-4020(98)00181-1

Reference yield:

2,5-bis(2-hydroxyethyl)-amino-nitrobenzene (84041-77-0) + propyl bromide (106-94-5) → 1-(β-hydroxyethyl)amino-4-(N-β-hydroxyethyl-N-n-propyl)-amino-2-nitrobenzene hydrochloride (154146-72-2)

Guidance literature:

With hydrogenchloride; calcium carbonate; In ethanol; water;

upstream raw materials:

N-[4-(β-hydroxyethyl)amino-3-nitrophenyl]oxazolidone

Downstream raw materials:

2-nitro-1-amino-4-[bis-(2-hydroxyethyl)-amino]-benzene

2-hydroxy-5-N-(2'-hydroxyethyl)amino-1-nitrobenzene

1-(β-hydroxyethyl)amino-4-(N-β-hydroxyethyl-N-n-butyl)amino-2-nitrobenzenehydrochloride

1-(β-hydroxyethyl)amino-4-(N-β-hydroxyethyl-N-isobutyl)amino-2-nitrobenzene hydrochloride

Refernces