7-Bromofuro[3,2-c]pyridin-4(5H)-one

Base Information

• Chemical Name: 7-Bromofuro[3,2-c]pyridin-4(5H)-one
• CAS No.: 603301-02-6
• Molecular Formula: C7H4BrNO2
• Molecular Weight: 214.018
• Hs Code.: 2934999090
• DSSTox Substance ID: DTXSID10591954
• Wikidata: Q72456653
• Mol file: 603301-02-6.mol

Synonyms:7-Bromofuro[3,2-c]pyridin-4(5H)-one;603301-02-6;7-bromo-5H-furo[3,2-c]pyridin-4-one;7-bromofuro[3,2-c]pyridine-4(5H)-one;MFCD11846190;7-bromo-4H,5H-furo[3,2-c]pyridin-4-one;Furo[3,2-c]pyridin-4(5H)-one, 7-bromo-;SCHEMBL2261528;DTXSID10591954;YFKFZPQHCJAURO-UHFFFAOYSA-N;BCP32369;SC1281;AKOS015835032;AM85841;FS-3395;SY112517;7-Bromo-5H-furo-[3,2-c]pyridin-4-one;7-bromo-5H-furo[3,2-c]pyridin-4- one;DB-072777;7-Bromofuro[3,2-c]pyridin-4(5H)-one 95+%;A868998;J-519159;7-Bromo-5H-furo[3,2-c]pyridin-4-one

Chemical Property of 7-Bromofuro[3,2-c]pyridin-4(5H)-one

Chemical Property:

• Vapor Pressure: 1.19E-06mmHg at 25°C
• Boiling Point: 401.3oC at 760 mmHg
• PKA: 10.40±0.40(Predicted)
• Flash Point: 196.5oC
• PSA: 46.00000
• Density: 1.825g/cm3
• LogP: 1.88360
• Storage Temp.: Sealed in dry,Room Temperature
• XLogP3: 0.8
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 212.94254
• Heavy Atom Count: 11
• Complexity: 227

Purity/Quality:

97% ^*data from raw suppliers

7-Bromofuro[3,2-c]pyridin-4(5h)-one ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=COC2=C1C(=O)NC=C2Br

Technology Process of 7-Bromofuro[3,2-c]pyridin-4(5H)-one

There total 4 articles about 7-Bromofuro[3,2-c]pyridin-4(5H)-one 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: 75.0%

5H-furo[3,2-c]pyridin-4-one (26956-43-4) → 7-bromofuro[3,2-c]pyridine-4(5H)-one (603301-02-6)

Guidance literature:

With N-Bromosuccinimide;

DOI:10.1016/j.bmcl.2004.12.063

Reference yield:

furfural (98-01-1) → 7-bromofuro[3,2-c]pyridine-4(5H)-one (603301-02-6)

Guidance literature:

Multi-step reaction with 4 steps

1.1: pyridine; piperidine / 16 h / 100 °C

2.1: diphenyl phosphoryl azide; triethylamine / tetrahydrofuran / 4 h / 25 °C / Cooling with ice

3.1: toluene / 0.5 h / 100 °C

3.2: 2 h / 180 °C

4.1: N-Bromosuccinimide / acetonitrile / 1.33 h / 0 - 20 °C

With piperidine; pyridine; N-Bromosuccinimide; diphenyl phosphoryl azide; triethylamine; In tetrahydrofuran; toluene; acetonitrile;

Reference yield:

3-(fur-2-yl)crotonic acid (539-47-9,15690-24-1) → 7-bromofuro[3,2-c]pyridine-4(5H)-one (603301-02-6)

Guidance literature:

Multi-step reaction with 3 steps

1.1: diphenyl phosphoryl azide; triethylamine / tetrahydrofuran / 4 h / 25 °C / Cooling with ice

2.1: toluene / 0.5 h / 100 °C

2.2: 2 h / 180 °C

3.1: N-Bromosuccinimide / acetonitrile / 1.33 h / 0 - 20 °C

With N-Bromosuccinimide; diphenyl phosphoryl azide; triethylamine; In tetrahydrofuran; toluene; acetonitrile;

upstream raw materials:

5H-furo[3,2-c]pyridin-4-one

furfural

3-(fur-2-yl)crotonic acid

(E)-3-(2-furanyl)-2-propenoyl azide

Downstream raw materials:

4,7-dibromofuro[3,2-c]pyridine

7-bromofuro[3,2-c]pyridine

(furo[3,2-c]pyridin-7-yl)methanol

furo[3,2-c]pyridine-7-carbonitrile