2-Phenyl-1H-pyrrolo[2,3-c]pyridine

Base Information

• Chemical Name: 2-Phenyl-1H-pyrrolo[2,3-c]pyridine
• CAS No.: 2922-07-8
• Molecular Formula: C13H10 N2
• Molecular Weight: 194.236
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID50467225
• Nikkaji Number: J747.048G
• Wikidata: Q82294038
• Mol file: 2922-07-8.mol

Synonyms:2-Phenyl-1H-pyrrolo[2,3-c]pyridine;2922-07-8;SCHEMBL6492488;DTXSID50467225;RSALELMHSRVFHR-UHFFFAOYSA-N;MFCD07776792;AKOS006287769;FT-0691834

Chemical Property of 2-Phenyl-1H-pyrrolo[2,3-c]pyridine

Chemical Property:

• Vapor Pressure: 5.58E-07mmHg at 25°C
• Melting Point: 229-231 °C
• Refractive Index: 1.688
• Boiling Point: 423.3°Cat760mmHg
• PKA: 14.46±0.40(Predicted)
• Flash Point: 194.7°C
• PSA: 28.68000
• Density: 1.211g/cm³
• LogP: 3.22990
• XLogP3: 2.6
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 1
• Exact Mass: 194.084398327
• Heavy Atom Count: 15
• Complexity: 211

Purity/Quality:

99% ^*data from raw suppliers

2-PHENYL-1H-PYRROLO[2,3-C]PYRIDINE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1=CC=C(C=C1)C2=CC3=C(N2)C=NC=C3

Technology Process of 2-Phenyl-1H-pyrrolo[2,3-c]pyridine

There total 18 articles about 2-Phenyl-1H-pyrrolo[2,3-c]pyridine 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: 91.0%

3-nitro-4-(2-phenylethenyl)pyridine (92961-16-5) → 2-phenyl-1H-pyrrolo[2,3-c]pyridine (2922-07-8)

Guidance literature:

With dichloro bis(acetonitrile) palladium(II); 1,10-Phenanthroline; phenyl formate; triethylamine; In acetonitrile; at 140 ℃; for 3h; Inert atmosphere;

DOI:10.1002/cctc.201701214

Reference yield: 91.0%

3-nitro-4-[(E)-2-phenylethenyl]pyridine (92961-16-5) → 2-phenyl-1H-pyrrolo[2,3-c]pyridine (2922-07-8)

Guidance literature:

With dichloro bis(acetonitrile) palladium(II); 1,10-Phenanthroline; phenyl formate; triethylamine; In acetonitrile; at 140 ℃; for 3h; Inert atmosphere; Schlenk technique; Sealed tube;

DOI:10.1002/ejoc.202100789

Reference yield: 88.0%

3-amino-4-methylpyridine (3430-27-1) + benzoic acid ethyl ester (93-89-0,99341-95-4) → N-(4-methyl-[3]pyridyl)-benzamide (2922-05-6) + 2-phenyl-1H-pyrrolo[2,3-c]pyridine (2922-07-8)

Guidance literature:

With sec.-butyllithium; In tetrahydrofuran; cyclohexane; at -40 ℃; for 0.5h;

DOI:10.1021/jo0506480

upstream raw materials:

2-phenyl-1H-pyrrolo[2,3-c]pyridin-1-ol

3-amino-4-methylpyridine

benzoic acid ethyl ester

phenylacetylene

Downstream raw materials:

2-phenyl-1H-pyrrolo[2,3-c]pyridine-3-carbaldehyde

2-phenylpyrrolo[2,3-c]pyridine-1-carboxylic acid tert-butyl ester