(Z)-2-((3,7-Dimethyl-2,6-octadienyl)nitrosoamino)ethanol

Base Information

• Chemical Name: (Z)-2-((3,7-Dimethyl-2,6-octadienyl)nitrosoamino)ethanol
• CAS No.: 80324-66-9
• Molecular Formula: C₁₂H₂₂N₂O₂
• Molecular Weight: 226.319
• Mol file: 80324-66-9.mol

Synonyms:(Z)-2-((3,7-Dimethyl-2,6-octadienyl)nitrosoamino)ethanol;80324-66-9;Ethanol, 2-((3,7-dimethyl-2,6-octadienyl)nitrosoamino)-, (Z)-

Chemical Property of (Z)-2-((3,7-Dimethyl-2,6-octadienyl)nitrosoamino)ethanol

Chemical Property:

• Vapor Pressure: 1.15E-07mmHg at 25°C
• Boiling Point: 389.2°C at 760 mmHg
• Flash Point: 189.2°C
• PSA: 52.90000
• Density: 0.97g/cm³
• LogP: 2.65480
• XLogP3: 2.9
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 7
• Exact Mass: 226.168127949
• Heavy Atom Count: 16
• Complexity: 256

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=CCCC(=CCN(CCO)N=O)C)C
• Isomeric SMILES: CC(=CCC/C(=C\CN(CCO)N=O)/C)C

Technology Process of (Z)-2-((3,7-Dimethyl-2,6-octadienyl)nitrosoamino)ethanol

There total 2 articles about (Z)-2-((3,7-Dimethyl-2,6-octadienyl)nitrosoamino)ethanol 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:

(2-hydroxyethyl)digeranylamine (19902-04-6) → cis-N-nitroso-2-(3',7'-dimethyl-2',6'-octadienyl)aminoethanol (80324-66-9) + trans-N-nitroso-2-(3',7'-dimethyl-2',6'-octadienyl)aminoethanol (80324-65-8)

Guidance literature:

With phosphate buffer; sodium nitrite; In water; N,N-dimethyl-formamide; at 85 ℃; for 2h; Yield given. Yields of byproduct given. Title compound not separated from byproducts;

DOI:10.1021/jo00364a013

Reference yield:

N-(2-Hydroxy-ethyl)-digeranylamin (56348-69-7) → cis-N-nitroso-2-(3',7'-dimethyl-2',6'-octadienyl)aminoethanol (80324-66-9) + trans-N-nitroso-2-(3',7'-dimethyl-2',6'-octadienyl)aminoethanol (80324-65-8)

Guidance literature:

With Nitrite; In acetic acid; at 20 ℃; for 12h; Product distribution; other temperature; other time; other pH;

DOI:10.1021/ac00240a036

upstream raw materials:

N-(2-Hydroxy-ethyl)-digeranylamin

(2-hydroxyethyl)digeranylamine

Refernces