3-Methyleneindolenine

Base Information

• Chemical Name: 3-Methyleneindolenine
• CAS No.: 40642-83-9
• Molecular Formula: C9H7N
• Molecular Weight: 129.1586
• DSSTox Substance ID: DTXSID00193643
• Nikkaji Number: J373.234G
• Wikidata: Q27132906
• Metabolomics Workbench ID: 41456
• Mol file: 40642-83-9.mol

Synonyms:3-methylene-indolenine;3-methyleneindolenine;3-methyleneindolenine, conjugate acid

Chemical Property of 3-Methyleneindolenine

Chemical Property:

• Vapor Pressure: 0.0194mmHg at 25°C
• Boiling Point: 260.8°Cat760mmHg
• Flash Point: 103.3°C
• PSA: 12.36000
• Density: 1.04g/cm³
• LogP: 1.85130
• XLogP3: 1.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 129.057849228
• Heavy Atom Count: 10
• Complexity: 181

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C=C1C=NC2=CC=CC=C12

Technology Process of 3-Methyleneindolenine

There total 2 articles about 3-Methyleneindolenine 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:

3-(Dimethylaminomethyl)indole (87-52-5) → 3-methyleneindolenine (40642-83-9)

Guidance literature:

at 700 ℃; flash pyrolysis;

DOI:10.1016/S0040-4039(00)77524-1

Reference yield:

3-Methylindole (83-34-1) → 3-methyleneindolenine (40642-83-9)

Guidance literature:

With phosphate buffer; goat lung microsomes (cytochrome 450); NADPH; at 37 ℃; for 0.0333333h; pH=7.4; Enzyme kinetics;

DOI:10.1021/tx9501187

upstream raw materials:

3-(Dimethylaminomethyl)indole

3-Methylindole