1,3,5-Trinitro-2-propoxybenzene

Base Information

• Chemical Name: 1,3,5-Trinitro-2-propoxybenzene
• CAS No.: 10242-24-7
• Molecular Formula: C9H9N3O7
• Molecular Weight: 271.186
• DSSTox Substance ID: DTXSID70541450
• Wikidata: Q82417818
• Mol file: 10242-24-7.mol

Synonyms:1,3,5-Trinitro-2-propoxybenzene;n-propyl picryl ether;10242-24-7;DTXSID70541450

Chemical Property of 1,3,5-Trinitro-2-propoxybenzene

Chemical Property:

• XLogP3: 2.3
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 7
• Rotatable Bond Count: 3
• Exact Mass: 271.04404963
• Heavy Atom Count: 19
• Complexity: 334

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCOC1=C(C=C(C=C1[N+](=O)[O-])[N+](=O)[O-])[N+](=O)[O-]

Technology Process of 1,3,5-Trinitro-2-propoxybenzene

There total 8 articles about 1,3,5-Trinitro-2-propoxybenzene 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:

C12H16N3O8(1-)*Na(1+) + C12H16N3O8(1-)*Na(1+) → n-propyl-2,4,6-trinitrophenyl ether (10242-24-7) + sodium n-propoxide (6819-41-6)

Guidance literature:

In propan-1-ol; at 25 ℃; Equilibrium constant; also in the presence of NaBPh₄;

Reference yield:

C11H14N3O8(1-) → n-propyl-2,4,6-trinitrophenyl ether (10242-24-7) + sodium ethanolate (141-52-6)

Guidance literature:

In ethanol; at 25 ℃; Equilibrium constant; measured by UV spectroscopy;

Reference yield:

propan-1-ol (71-23-8) + 2,4,6-trinitrochlorobenzene (88-88-0) → n-propyl-2,4,6-trinitrophenyl ether (10242-24-7)

Guidance literature:

With potassium hydroxide; Behandeln des Reaktionsprodukts mit wss. Salzsaeure;

DOI:10.1021/ja01163a502

upstream raw materials:

propan-1-ol

2,4,6-trinitrochlorobenzene

sodium n-propoxide

1-iodo-propane

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