2,3-Epoxy-4-hydroxynonanal

Base Information

• Chemical Name: 2,3-Epoxy-4-hydroxynonanal
• CAS No.: 118354-84-0
• Molecular Formula: C₉H₁₆O₃
• Molecular Weight: 172.224
• DSSTox Substance ID: DTXSID90922666
• Nikkaji Number: J357.907G
• Mol file: 118354-84-0.mol

Synonyms:2,3-epoxy-4-hydroxynonanal;2,3-epoxy-4-hydroxynonanal, (2alpha,3beta(R*)), (+-)-isomer

Chemical Property of 2,3-Epoxy-4-hydroxynonanal

Chemical Property:

• Vapor Pressure: 0.000524mmHg at 25°C
• Refractive Index: 1.535
• Boiling Point: 278.3°Cat760mmHg
• PKA: 14?+-.0.20(Predicted)
• Flash Point: 106.7°C
• PSA: 49.83000
• Density: 1.148g/cm³
• LogP: 0.89390
• XLogP3: 1.2
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 6
• Exact Mass: 172.109944368
• Heavy Atom Count: 12
• Complexity: 147

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CCCCCC(C1C(O1)C=O)O

Technology Process of 2,3-Epoxy-4-hydroxynonanal

There total 1 articles about 2,3-Epoxy-4-hydroxynonanal 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:

4-hydroxynon-2-enal (850480-50-1,18286-49-2,29343-52-0) → 2,3-epoxy-4-hydroxynonanal (118354-84-0,133398-57-9,152375-23-0,152322-55-9)

Guidance literature:

With tert.-butylhydroperoxide; sodium hydroxide; In methanol; water; at 0 - 20 ℃; for 3.5h; pH=8;

DOI:10.1021/tx0000771

Reference yield: 21.0%

methanol (67-56-1) + (2,4-dinitro-phenyl)-hydrazine (119-26-6) + 2,3-epoxy-4-hydroxynonanal (118354-84-0,133398-57-9,152375-23-0,152322-55-9) → 3,4-dihydroxy-2-methoxynonanal (2',4'-dinitrophenyl)hydrazone

Guidance literature:

With hydrogenchloride; at 37 ℃; for 2h;

DOI:10.1021/tx9501389

Reference yield:

2,3-epoxy-4-hydroxynonanal (118354-84-0,133398-57-9,152375-23-0,152322-55-9) → 3,4-diacetoxy-2-methoxynonanal (2',4'-dinitrophenyl)hydrazone

Guidance literature:

Multi-step reaction with 2 steps

1: 21 percent / 1N HCl / 2 h / 37 °C

2: 50 percent / 4-(dimethylamino)pyridine / 1.5 h / 20 °C

With hydrogenchloride; dmap; 1: Condensation / 2: Acetylation;

DOI:10.1021/tx9501389

upstream raw materials:

4-hydroxynon-2-enal