2-Hydroxyimino-6-methoxy-4-methyl-5-nitrohex-3-enamide

Base Information

• Chemical Name: 2-Hydroxyimino-6-methoxy-4-methyl-5-nitrohex-3-enamide
• CAS No.: 163032-70-0
• Molecular Formula: C₈H₁₃N₃O₅
• Molecular Weight: 231.208
• European Community (EC) Number: 634-065-7
• Mol file: 163032-70-0.mol

Synonyms:nor-1;163032-70-0;(+/-)-(E)-Methyl-2-[(E)-hydroxyimino]-5-nitro-6-methoxy-3-hexeneamide;(2E,3E)-2-(HYDROXYIMINO)-6-METHOXY-4-METHYL-5-NITROHEX-3-ENAMIDE

Chemical Property of 2-Hydroxyimino-6-methoxy-4-methyl-5-nitrohex-3-enamide

Chemical Property:

• Appearance/Colour: white or slightly yellow powder
• Vapor Pressure: 2.02E-10mmHg at 25°C
• Boiling Point: 460.6 °C at 760 mmHg
• Flash Point: 232.4 °C
• PSA: 130.73000
• Density: 1.37 g/cm³
• LogP: 0.76340
• Storage Temp.: −20°C
• XLogP3: 0.6
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 5
• Exact Mass: 231.08552052
• Heavy Atom Count: 16
• Complexity: 331

Purity/Quality:

99%min ^*data from raw suppliers

NOR-1 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s): Xi
• Hazard Codes: Xi
• Statements: 36/37/38
• Safety Statements: 26-36

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=CC(=NO)C(=O)N)C(COC)[N+](=O)[O-]

Technology Process of 2-Hydroxyimino-6-methoxy-4-methyl-5-nitrohex-3-enamide

There total 2 articles about 2-Hydroxyimino-6-methoxy-4-methyl-5-nitrohex-3-enamide 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:

(2E,4E)-6-Methoxy-4-methyl-hexa-2,4-dienoic acid amide → (+/-)-(E)-4-methyl-2-[(E)-hydroxyimino]-5-nitro-6-methoxy-3-hexenamide (163032-70-0)

Guidance literature:

With hydrogenchloride; sodium nitrite; In water;

DOI:10.1016/0960-894X(95)00547-7

Reference yield:

(E)-4-methoxy-2-methyl-but-2-enal (4356-74-5) → (+/-)-(E)-4-methyl-2-[(E)-hydroxyimino]-5-nitro-6-methoxy-3-hexenamide (163032-70-0)

Guidance literature:

Multi-step reaction with 2 steps

1: t-BuOK

2: HCl, NaNO₂ / H₂O

With hydrogenchloride; potassium tert-butylate; sodium nitrite; In water;

DOI:10.1016/0960-894X(95)00547-7

upstream raw materials:

(E)-4-methoxy-2-methyl-but-2-enal

Refernces