Quinoxalin-2-ylmethanol

Base Information

• Chemical Name: Quinoxalin-2-ylmethanol
• CAS No.: 41242-94-8
• Molecular Formula: C9H8N2O
• Molecular Weight: 160.175
• Hs Code.: 2933990090
• European Community (EC) Number: 828-425-4
• DSSTox Substance ID: DTXSID30358622
• Nikkaji Number: J3.270.682G
• Wikidata: Q82139326
• Mol file: 41242-94-8.mol

Synonyms:quinoxalin-2-ylmethanol;41242-94-8;2-(HYDROXYMETHYL)QUINOXALINE;(quinoxalin-2-yl)methanol;MFCD00781872;Quinoxalin-2-yl-methanol;2-Quinoxalinylmethanol;hydroxymethylquinoxaline;quinoxaline-2-yl-methanol;SCHEMBL3271716;DTXSID30358622;PZLGAOXMPNXQBW-UHFFFAOYSA-N;AMY41966;STK806341;AKOS005607762;1,8a-Dihydroquinoxaline-2-carbaldehyde;AS-38791;SY024806;CS-0187626;FT-0734765;EN300-55318;J-504054

Chemical Property of Quinoxalin-2-ylmethanol

Chemical Property:

• Vapor Pressure: 0.000262mmHg at 25°C
• Melting Point: 79-80 °C
• Boiling Point: 310.2oC at 760 mmHg
• PKA: 13.34±0.10(Predicted)
• Flash Point: 141.4oC
• PSA: 46.01000
• Density: 1.293g/cm3
• LogP: 1.12210
• XLogP3: 0.4
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 1
• Exact Mass: 160.063662883
• Heavy Atom Count: 12
• Complexity: 152

Purity/Quality:

97% ^*data from raw suppliers

Quinoxalin-2-ylmethanol ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C2C(=C1)N=CC(=N2)CO
• Uses: Quinoxalin-2-ylmethanol can be used as ketolide antibiotics.

Technology Process of Quinoxalin-2-ylmethanol

There total 9 articles about Quinoxalin-2-ylmethanol 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: 72.0%

C16H12N2O2 (1025351-09-0) → 2-hydroxymethylquinoxaline (41242-94-8)

Guidance literature:

With sodium methylate; In methanol; at 20 ℃; for 12h;

DOI:10.1055/s-2008-1032084

Reference yield: 33.0%

→ 2-hydroxymethylquinoxaline (41242-94-8)

Guidance literature:

Reference yield: 30.2%

dihydroxyacetone (96-26-4,26776-70-5) + 1,2-diamino-benzene (95-54-5) → 2-hydroxymethylquinoxaline (41242-94-8)

Guidance literature:

With palladium diacetate; triethylamine; In dimethyl sulfoxide; at 80 ℃; for 3h;

DOI:10.1021/jm501145a

upstream raw materials:

Quinoxaline-2-carboxaldehyde

formaldehyd

2-oxo-propionic acid

1,2-diamino-benzene

Downstream raw materials:

2-chloromethyl-quinoxaline

Quinoxaline-2-carboxaldehyde