Ethyl 1-methylbutyl cyanoacetate

Base Information

• Chemical Name: Ethyl 1-methylbutyl cyanoacetate
• CAS No.: 100453-11-0
• Molecular Formula: C12H21NO2
• Molecular Weight: 211.304
• Hs Code.: 2926909090
• Mol file: 100453-11-0.mol

Synonyms:2-Cyano-2-ethyl-3-methylhexanoic acid ethyl ester;

Chemical Property of Ethyl 1-methylbutyl cyanoacetate

Chemical Property:

• Vapor Pressure: 0.3Pa at 24.85℃
• Refractive Index: 1.442
• Boiling Point: 240.784 °C at 760 mmHg
• Flash Point: 105.074 °C
• PSA: 50.09000
• Density: 0.944 g/cm³
• LogP: 2.90568
• Storage Temp.: 2-8°C
• Water Solubility.: 33.54mg/L at 25℃

Purity/Quality:

99.9% ^*data from raw suppliers

2-Cyano-2-ethyl-3-methylhexanoicAcidEthylEster ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

Technology Process of Ethyl 1-methylbutyl cyanoacetate

There total 6 articles about Ethyl 1-methylbutyl cyanoacetate 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-ethyl-2-cyano-3-methyl-hexanoic acid ethyl ester (100453-11-0)

Guidance literature:

With palladium on activated charcoal; ethanol; Hydrogenation;

Reference yield:

2-bromopentane (107-81-3) → 2-ethyl-2-cyano-3-methyl-hexanoic acid ethyl ester (100453-11-0)

Guidance literature:

Multi-step reaction with 2 steps

1: sodium ethylate; ethanol

2: sodium ethylate; ethanol

With ethanol; sodium ethanolate;

Reference yield:

ethyl 2-cyanoacetate (105-56-6) → 2-ethyl-2-cyano-3-methyl-hexanoic acid ethyl ester (100453-11-0)

Guidance literature:

Multi-step reaction with 2 steps

1: sodium ethylate; ethanol

2: sodium ethylate; ethanol

With ethanol; sodium ethanolate;

upstream raw materials:

2-bromopentane

2-cyano-butyric acid ethyl ester

2-cyano-3-methyl-hexanoic acid ethyl ester

ethyl iodide

Downstream raw materials:

thiopentone

5-ethyl-6-amino-5-(1-methyl-butyl)-2-thioxo-3,5-dihydro-2H-pyrimidin-4-one